Index of

Last updated : Thu Apr 27 02:27:22 JST 2017
Total : 356 (306) in this page
006025047.b3lyp_6-31g(d).inp

006025047.b3lyp_6-31g(d).qchem.inp (generated)

006025047.b3lyp_6-31g(d).gjf (generated)

006025047.b3lyp_6-31g(d).firefly.inp (generated)

006025047.b3lyp_6-31g(d).smash.inp (generated)

006025047.b3lyp_6-31g(d).nwchem.inp (generated) 006025047.b3lyp_6-31g(d).log.xz 006025047.mol 006025047.PUBCHEM 006025047.mol (via Jmol)
006025068.b3lyp_6-31g(d).inp

006025068.b3lyp_6-31g(d).qchem.inp (generated)

006025068.b3lyp_6-31g(d).gjf (generated)

006025068.b3lyp_6-31g(d).firefly.inp (generated)

006025068.b3lyp_6-31g(d).smash.inp (generated)

006025068.b3lyp_6-31g(d).nwchem.inp (generated) 006025068.b3lyp_6-31g(d).log.xz 006025068.td-b3lyp_6-31g+(d).inp 006025068.td-b3lyp_6-31g+(d).log.xz

006025068.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025068.td-b3lyp_6-31+g(d).gjf (generated)

006025068.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025068.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025068.mol 006025068.PUBCHEM 006025068.mol (via Jmol)
006025137.b3lyp_6-31g(d).inp

006025137.b3lyp_6-31g(d).qchem.inp (generated)

006025137.b3lyp_6-31g(d).gjf (generated)

006025137.b3lyp_6-31g(d).firefly.inp (generated)

006025137.b3lyp_6-31g(d).smash.inp (generated)

006025137.b3lyp_6-31g(d).nwchem.inp (generated) 006025137.b3lyp_6-31g(d).log.xz 006025137.td-b3lyp_6-31g+(d).inp 006025137.td-b3lyp_6-31g+(d).log.xz

006025137.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025137.td-b3lyp_6-31+g(d).gjf (generated)

006025137.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025137.mol 006025137.PUBCHEM 006025137.mol (via Jmol)
006025304.b3lyp_6-31g(d).inp

006025304.b3lyp_6-31g(d).qchem.inp (generated)

006025304.b3lyp_6-31g(d).gjf (generated)

006025304.b3lyp_6-31g(d).firefly.inp (generated)

006025304.b3lyp_6-31g(d).smash.inp (generated)

006025304.b3lyp_6-31g(d).nwchem.inp (generated) 006025304.b3lyp_6-31g(d).log.xz 006025304.td-b3lyp_6-31g+(d).inp 006025304.td-b3lyp_6-31g+(d).log.xz

006025304.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025304.td-b3lyp_6-31+g(d).gjf (generated)

006025304.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025304.mol 006025304.PUBCHEM 006025304.mol (via Jmol)
006025410.b3lyp_6-31g(d).inp

006025410.b3lyp_6-31g(d).qchem.inp (generated)

006025410.b3lyp_6-31g(d).gjf (generated)

006025410.b3lyp_6-31g(d).firefly.inp (generated)

006025410.b3lyp_6-31g(d).smash.inp (generated)

006025410.b3lyp_6-31g(d).nwchem.inp (generated) 006025410.b3lyp_6-31g(d).log.xz 006025410.td-b3lyp_6-31g+(d).inp 006025410.td-b3lyp_6-31g+(d).log.xz

006025410.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025410.td-b3lyp_6-31+g(d).gjf (generated)

006025410.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025410.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025410.mol 006025410.PUBCHEM 006025410.mol (via Jmol)
006025413.b3lyp_6-31g(d).inp

006025413.b3lyp_6-31g(d).qchem.inp (generated)

006025413.b3lyp_6-31g(d).gjf (generated)

006025413.b3lyp_6-31g(d).firefly.inp (generated)

006025413.b3lyp_6-31g(d).smash.inp (generated)

006025413.b3lyp_6-31g(d).nwchem.inp (generated) 006025413.b3lyp_6-31g(d).log.xz 006025413.td-b3lyp_6-31g+(d).inp 006025413.td-b3lyp_6-31g+(d).log.xz

006025413.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025413.td-b3lyp_6-31+g(d).gjf (generated)

006025413.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025413.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025413.mol 006025413.PUBCHEM 006025413.mol (via Jmol)
006025498.b3lyp_6-31g(d).inp

006025498.b3lyp_6-31g(d).qchem.inp (generated)

006025498.b3lyp_6-31g(d).gjf (generated)

006025498.b3lyp_6-31g(d).firefly.inp (generated)

006025498.b3lyp_6-31g(d).smash.inp (generated)

006025498.b3lyp_6-31g(d).nwchem.inp (generated) 006025498.b3lyp_6-31g(d).log.xz 006025498.td-b3lyp_6-31g+(d).inp 006025498.td-b3lyp_6-31g+(d).log.xz

006025498.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025498.td-b3lyp_6-31+g(d).gjf (generated)

006025498.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025498.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025498.mol 006025498.PUBCHEM 006025498.mol (via Jmol)
006025564.b3lyp_6-31g(d).inp

006025564.b3lyp_6-31g(d).qchem.inp (generated)

006025564.b3lyp_6-31g(d).gjf (generated)

006025564.b3lyp_6-31g(d).firefly.inp (generated)

006025564.b3lyp_6-31g(d).smash.inp (generated)

006025564.b3lyp_6-31g(d).nwchem.inp (generated) 006025564.b3lyp_6-31g(d).log.xz 006025564.mol 006025564.PUBCHEM 006025564.mol (via Jmol)
006025836.b3lyp_6-31g(d).inp

006025836.b3lyp_6-31g(d).qchem.inp (generated)

006025836.b3lyp_6-31g(d).gjf (generated)

006025836.b3lyp_6-31g(d).firefly.inp (generated)

006025836.b3lyp_6-31g(d).smash.inp (generated)

006025836.b3lyp_6-31g(d).nwchem.inp (generated) 006025836.b3lyp_6-31g(d).log.xz 006025836.td-b3lyp_6-31g+(d).inp 006025836.td-b3lyp_6-31g+(d).log.xz

006025836.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025836.td-b3lyp_6-31+g(d).gjf (generated)

006025836.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025836.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025836.mol 006025836.PUBCHEM 006025836.mol (via Jmol)
006025929.b3lyp_6-31g(d).inp

006025929.b3lyp_6-31g(d).qchem.inp (generated)

006025929.b3lyp_6-31g(d).gjf (generated)

006025929.b3lyp_6-31g(d).firefly.inp (generated)

006025929.b3lyp_6-31g(d).smash.inp (generated)

006025929.b3lyp_6-31g(d).nwchem.inp (generated) 006025929.b3lyp_6-31g(d).log.xz 006025929.td-b3lyp_6-31g+(d).inp 006025929.td-b3lyp_6-31g+(d).log.xz

006025929.td-b3lyp_6-31+g(d).qchem.inp (generated)

006025929.td-b3lyp_6-31+g(d).gjf (generated)

006025929.td-b3lyp_6-31+g(d).firefly.inp (generated)

006025929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006025929.mol 006025929.PUBCHEM 006025929.mol (via Jmol)
006026016.b3lyp_6-31g(d).inp

006026016.b3lyp_6-31g(d).qchem.inp (generated)

006026016.b3lyp_6-31g(d).gjf (generated)

006026016.b3lyp_6-31g(d).firefly.inp (generated)

006026016.b3lyp_6-31g(d).smash.inp (generated)

006026016.b3lyp_6-31g(d).nwchem.inp (generated) 006026016.b3lyp_6-31g(d).log.xz 006026016.mol 006026016.PUBCHEM 006026016.mol (via Jmol)
006026050.b3lyp_6-31g(d).inp

006026050.b3lyp_6-31g(d).qchem.inp (generated)

006026050.b3lyp_6-31g(d).gjf (generated)

006026050.b3lyp_6-31g(d).firefly.inp (generated)

006026050.b3lyp_6-31g(d).smash.inp (generated)

006026050.b3lyp_6-31g(d).nwchem.inp (generated) 006026050.b3lyp_6-31g(d).log.xz 006026050.td-b3lyp_6-31g+(d).inp 006026050.td-b3lyp_6-31g+(d).log.xz

006026050.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026050.td-b3lyp_6-31+g(d).gjf (generated)

006026050.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026050.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026050.mol 006026050.PUBCHEM 006026050.mol (via Jmol)
006026096.b3lyp_6-31g(d).inp

006026096.b3lyp_6-31g(d).qchem.inp (generated)

006026096.b3lyp_6-31g(d).gjf (generated)

006026096.b3lyp_6-31g(d).firefly.inp (generated)

006026096.b3lyp_6-31g(d).smash.inp (generated)

006026096.b3lyp_6-31g(d).nwchem.inp (generated) 006026096.b3lyp_6-31g(d).log.xz 006026096.td-b3lyp_6-31g+(d).inp 006026096.td-b3lyp_6-31g+(d).log.xz

006026096.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026096.td-b3lyp_6-31+g(d).gjf (generated)

006026096.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026096.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026096.mol 006026096.PUBCHEM 006026096.mol (via Jmol)
006026117.b3lyp_6-31g(d).inp

006026117.b3lyp_6-31g(d).qchem.inp (generated)

006026117.b3lyp_6-31g(d).gjf (generated)

006026117.b3lyp_6-31g(d).firefly.inp (generated)

006026117.b3lyp_6-31g(d).smash.inp (generated)

006026117.b3lyp_6-31g(d).nwchem.inp (generated) 006026117.b3lyp_6-31g(d).log.xz 006026117.td-b3lyp_6-31g+(d).inp 006026117.td-b3lyp_6-31g+(d).log.xz

006026117.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026117.td-b3lyp_6-31+g(d).gjf (generated)

006026117.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026117.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026117.mol 006026117.PUBCHEM 006026117.mol (via Jmol)
006026273.b3lyp_6-31g(d).inp

006026273.b3lyp_6-31g(d).qchem.inp (generated)

006026273.b3lyp_6-31g(d).gjf (generated)

006026273.b3lyp_6-31g(d).firefly.inp (generated)

006026273.b3lyp_6-31g(d).smash.inp (generated)

006026273.b3lyp_6-31g(d).nwchem.inp (generated) 006026273.b3lyp_6-31g(d).log.xz 006026273.td-b3lyp_6-31g+(d).inp 006026273.td-b3lyp_6-31g+(d).log.xz

006026273.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026273.td-b3lyp_6-31+g(d).gjf (generated)

006026273.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026273.mol 006026273.PUBCHEM 006026273.mol (via Jmol)
006026380.b3lyp_6-31g(d).inp

006026380.b3lyp_6-31g(d).qchem.inp (generated)

006026380.b3lyp_6-31g(d).gjf (generated)

006026380.b3lyp_6-31g(d).firefly.inp (generated)

006026380.b3lyp_6-31g(d).smash.inp (generated)

006026380.b3lyp_6-31g(d).nwchem.inp (generated) 006026380.b3lyp_6-31g(d).log.xz 006026380.td-b3lyp_6-31g+(d).inp 006026380.td-b3lyp_6-31g+(d).log.xz

006026380.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026380.td-b3lyp_6-31+g(d).gjf (generated)

006026380.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026380.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026380.mol 006026380.PUBCHEM 006026380.mol (via Jmol)
006026435.b3lyp_6-31g(d).inp

006026435.b3lyp_6-31g(d).qchem.inp (generated)

006026435.b3lyp_6-31g(d).gjf (generated)

006026435.b3lyp_6-31g(d).firefly.inp (generated)

006026435.b3lyp_6-31g(d).smash.inp (generated)

006026435.b3lyp_6-31g(d).nwchem.inp (generated) 006026435.b3lyp_6-31g(d).log.xz 006026435.td-b3lyp_6-31g+(d).inp 006026435.td-b3lyp_6-31g+(d).log.xz

006026435.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026435.td-b3lyp_6-31+g(d).gjf (generated)

006026435.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026435.mol 006026435.PUBCHEM 006026435.mol (via Jmol)
006026573.b3lyp_6-31g(d).inp

006026573.b3lyp_6-31g(d).qchem.inp (generated)

006026573.b3lyp_6-31g(d).gjf (generated)

006026573.b3lyp_6-31g(d).firefly.inp (generated)

006026573.b3lyp_6-31g(d).smash.inp (generated)

006026573.b3lyp_6-31g(d).nwchem.inp (generated) 006026573.b3lyp_6-31g(d).log.xz 006026573.mol 006026573.PUBCHEM 006026573.mol (via Jmol)
006026599.b3lyp_6-31g(d).inp

006026599.b3lyp_6-31g(d).qchem.inp (generated)

006026599.b3lyp_6-31g(d).gjf (generated)

006026599.b3lyp_6-31g(d).firefly.inp (generated)

006026599.b3lyp_6-31g(d).smash.inp (generated)

006026599.b3lyp_6-31g(d).nwchem.inp (generated) 006026599.b3lyp_6-31g(d).log.xz 006026599.td-b3lyp_6-31g+(d).inp 006026599.td-b3lyp_6-31g+(d).log.xz

006026599.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026599.td-b3lyp_6-31+g(d).gjf (generated)

006026599.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026599.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026599.mol 006026599.PUBCHEM 006026599.mol (via Jmol)
006026700.b3lyp_6-31g(d).inp

006026700.b3lyp_6-31g(d).qchem.inp (generated)

006026700.b3lyp_6-31g(d).gjf (generated)

006026700.b3lyp_6-31g(d).firefly.inp (generated)

006026700.b3lyp_6-31g(d).smash.inp (generated)

006026700.b3lyp_6-31g(d).nwchem.inp (generated) 006026700.b3lyp_6-31g(d).log.xz 006026700.td-b3lyp_6-31g+(d).inp 006026700.td-b3lyp_6-31g+(d).log.xz

006026700.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026700.td-b3lyp_6-31+g(d).gjf (generated)

006026700.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026700.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026700.mol 006026700.PUBCHEM 006026700.mol (via Jmol)
006026727.b3lyp_6-31g(d).inp

006026727.b3lyp_6-31g(d).qchem.inp (generated)

006026727.b3lyp_6-31g(d).gjf (generated)

006026727.b3lyp_6-31g(d).firefly.inp (generated)

006026727.b3lyp_6-31g(d).smash.inp (generated)

006026727.b3lyp_6-31g(d).nwchem.inp (generated) 006026727.b3lyp_6-31g(d).log.xz 006026727.td-b3lyp_6-31g+(d).inp 006026727.td-b3lyp_6-31g+(d).log.xz

006026727.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026727.td-b3lyp_6-31+g(d).gjf (generated)

006026727.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026727.mol 006026727.PUBCHEM 006026727.mol (via Jmol)
006026762.b3lyp_6-31g(d).inp

006026762.b3lyp_6-31g(d).qchem.inp (generated)

006026762.b3lyp_6-31g(d).gjf (generated)

006026762.b3lyp_6-31g(d).firefly.inp (generated)

006026762.b3lyp_6-31g(d).smash.inp (generated)

006026762.b3lyp_6-31g(d).nwchem.inp (generated) 006026762.b3lyp_6-31g(d).log.xz 006026762.td-b3lyp_6-31g+(d).inp 006026762.td-b3lyp_6-31g+(d).log.xz

006026762.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026762.td-b3lyp_6-31+g(d).gjf (generated)

006026762.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026762.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026762.mol 006026762.PUBCHEM 006026762.mol (via Jmol)
006026906.b3lyp_6-31g(d).inp

006026906.b3lyp_6-31g(d).qchem.inp (generated)

006026906.b3lyp_6-31g(d).gjf (generated)

006026906.b3lyp_6-31g(d).firefly.inp (generated)

006026906.b3lyp_6-31g(d).smash.inp (generated)

006026906.b3lyp_6-31g(d).nwchem.inp (generated) 006026906.b3lyp_6-31g(d).log.xz 006026906.td-b3lyp_6-31g+(d).inp 006026906.td-b3lyp_6-31g+(d).log.xz

006026906.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026906.td-b3lyp_6-31+g(d).gjf (generated)

006026906.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026906.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026906.mol 006026906.PUBCHEM 006026906.mol (via Jmol)
006026910.b3lyp_6-31g(d).inp

006026910.b3lyp_6-31g(d).qchem.inp (generated)

006026910.b3lyp_6-31g(d).gjf (generated)

006026910.b3lyp_6-31g(d).firefly.inp (generated)

006026910.b3lyp_6-31g(d).smash.inp (generated)

006026910.b3lyp_6-31g(d).nwchem.inp (generated) 006026910.b3lyp_6-31g(d).log.xz 006026910.td-b3lyp_6-31g+(d).inp 006026910.td-b3lyp_6-31g+(d).log.xz

006026910.td-b3lyp_6-31+g(d).qchem.inp (generated)

006026910.td-b3lyp_6-31+g(d).gjf (generated)

006026910.td-b3lyp_6-31+g(d).firefly.inp (generated)

006026910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006026910.mol 006026910.PUBCHEM 006026910.mol (via Jmol)
006027063.b3lyp_6-31g(d).inp

006027063.b3lyp_6-31g(d).qchem.inp (generated)

006027063.b3lyp_6-31g(d).gjf (generated)

006027063.b3lyp_6-31g(d).firefly.inp (generated)

006027063.b3lyp_6-31g(d).smash.inp (generated)

006027063.b3lyp_6-31g(d).nwchem.inp (generated) 006027063.b3lyp_6-31g(d).log.xz 006027063.td-b3lyp_6-31g+(d).inp 006027063.td-b3lyp_6-31g+(d).log.xz

006027063.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027063.td-b3lyp_6-31+g(d).gjf (generated)

006027063.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027063.mol 006027063.PUBCHEM 006027063.mol (via Jmol)
006027185.b3lyp_6-31g(d).inp

006027185.b3lyp_6-31g(d).qchem.inp (generated)

006027185.b3lyp_6-31g(d).gjf (generated)

006027185.b3lyp_6-31g(d).firefly.inp (generated)

006027185.b3lyp_6-31g(d).smash.inp (generated)

006027185.b3lyp_6-31g(d).nwchem.inp (generated) 006027185.b3lyp_6-31g(d).log.xz 006027185.td-b3lyp_6-31g+(d).inp 006027185.td-b3lyp_6-31g+(d).log.xz

006027185.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027185.td-b3lyp_6-31+g(d).gjf (generated)

006027185.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027185.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027185.mol 006027185.PUBCHEM 006027185.mol (via Jmol)
006027348.b3lyp_6-31g(d).inp

006027348.b3lyp_6-31g(d).qchem.inp (generated)

006027348.b3lyp_6-31g(d).gjf (generated)

006027348.b3lyp_6-31g(d).firefly.inp (generated)

006027348.b3lyp_6-31g(d).smash.inp (generated)

006027348.b3lyp_6-31g(d).nwchem.inp (generated) 006027348.b3lyp_6-31g(d).log.xz 006027348.td-b3lyp_6-31g+(d).inp 006027348.td-b3lyp_6-31g+(d).log.xz

006027348.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027348.td-b3lyp_6-31+g(d).gjf (generated)

006027348.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027348.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027348.mol 006027348.PUBCHEM 006027348.mol (via Jmol)
006027556.b3lyp_6-31g(d).inp

006027556.b3lyp_6-31g(d).qchem.inp (generated)

006027556.b3lyp_6-31g(d).gjf (generated)

006027556.b3lyp_6-31g(d).firefly.inp (generated)

006027556.b3lyp_6-31g(d).smash.inp (generated)

006027556.b3lyp_6-31g(d).nwchem.inp (generated) 006027556.b3lyp_6-31g(d).log.xz 006027556.td-b3lyp_6-31g+(d).inp 006027556.td-b3lyp_6-31g+(d).log.xz

006027556.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027556.td-b3lyp_6-31+g(d).gjf (generated)

006027556.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027556.mol 006027556.PUBCHEM 006027556.mol (via Jmol)
006027626.b3lyp_6-31g(d).inp

006027626.b3lyp_6-31g(d).qchem.inp (generated)

006027626.b3lyp_6-31g(d).gjf (generated)

006027626.b3lyp_6-31g(d).firefly.inp (generated)

006027626.b3lyp_6-31g(d).smash.inp (generated)

006027626.b3lyp_6-31g(d).nwchem.inp (generated) 006027626.b3lyp_6-31g(d).log.xz 006027626.mol 006027626.PUBCHEM 006027626.mol (via Jmol)
006027647.b3lyp_6-31g(d).inp

006027647.b3lyp_6-31g(d).qchem.inp (generated)

006027647.b3lyp_6-31g(d).gjf (generated)

006027647.b3lyp_6-31g(d).firefly.inp (generated)

006027647.b3lyp_6-31g(d).smash.inp (generated)

006027647.b3lyp_6-31g(d).nwchem.inp (generated) 006027647.b3lyp_6-31g(d).log.xz 006027647.td-b3lyp_6-31g+(d).inp 006027647.td-b3lyp_6-31g+(d).log.xz

006027647.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027647.td-b3lyp_6-31+g(d).gjf (generated)

006027647.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027647.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027647.mol 006027647.PUBCHEM 006027647.mol (via Jmol)
006027769.b3lyp_6-31g(d).inp

006027769.b3lyp_6-31g(d).qchem.inp (generated)

006027769.b3lyp_6-31g(d).gjf (generated)

006027769.b3lyp_6-31g(d).firefly.inp (generated)

006027769.b3lyp_6-31g(d).smash.inp (generated)

006027769.b3lyp_6-31g(d).nwchem.inp (generated) 006027769.b3lyp_6-31g(d).log.xz 006027769.td-b3lyp_6-31g+(d).inp 006027769.td-b3lyp_6-31g+(d).log.xz

006027769.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027769.td-b3lyp_6-31+g(d).gjf (generated)

006027769.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027769.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027769.mol 006027769.PUBCHEM 006027769.mol (via Jmol)
006027937.b3lyp_6-31g(d).inp

006027937.b3lyp_6-31g(d).qchem.inp (generated)

006027937.b3lyp_6-31g(d).gjf (generated)

006027937.b3lyp_6-31g(d).firefly.inp (generated)

006027937.b3lyp_6-31g(d).smash.inp (generated)

006027937.b3lyp_6-31g(d).nwchem.inp (generated) 006027937.b3lyp_6-31g(d).log.xz 006027937.td-b3lyp_6-31g+(d).inp 006027937.td-b3lyp_6-31g+(d).log.xz

006027937.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027937.td-b3lyp_6-31+g(d).gjf (generated)

006027937.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027937.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027937.mol 006027937.PUBCHEM 006027937.mol (via Jmol)
006027967.b3lyp_6-31g(d).inp

006027967.b3lyp_6-31g(d).qchem.inp (generated)

006027967.b3lyp_6-31g(d).gjf (generated)

006027967.b3lyp_6-31g(d).firefly.inp (generated)

006027967.b3lyp_6-31g(d).smash.inp (generated)

006027967.b3lyp_6-31g(d).nwchem.inp (generated) 006027967.b3lyp_6-31g(d).log.xz 006027967.td-b3lyp_6-31g+(d).inp 006027967.td-b3lyp_6-31g+(d).log.xz

006027967.td-b3lyp_6-31+g(d).qchem.inp (generated)

006027967.td-b3lyp_6-31+g(d).gjf (generated)

006027967.td-b3lyp_6-31+g(d).firefly.inp (generated)

006027967.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006027967.mol 006027967.PUBCHEM 006027967.mol (via Jmol)
006028004.b3lyp_6-31g(d).inp

006028004.b3lyp_6-31g(d).qchem.inp (generated)

006028004.b3lyp_6-31g(d).gjf (generated)

006028004.b3lyp_6-31g(d).firefly.inp (generated)

006028004.b3lyp_6-31g(d).smash.inp (generated)

006028004.b3lyp_6-31g(d).nwchem.inp (generated) 006028004.b3lyp_6-31g(d).log.xz 006028004.td-b3lyp_6-31g+(d).inp 006028004.td-b3lyp_6-31g+(d).log.xz

006028004.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028004.td-b3lyp_6-31+g(d).gjf (generated)

006028004.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028004.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028004.mol 006028004.PUBCHEM 006028004.mol (via Jmol)
006028059.b3lyp_6-31g(d).inp

006028059.b3lyp_6-31g(d).qchem.inp (generated)

006028059.b3lyp_6-31g(d).gjf (generated)

006028059.b3lyp_6-31g(d).firefly.inp (generated)

006028059.b3lyp_6-31g(d).smash.inp (generated)

006028059.b3lyp_6-31g(d).nwchem.inp (generated) 006028059.b3lyp_6-31g(d).log.xz 006028059.td-b3lyp_6-31g+(d).inp 006028059.td-b3lyp_6-31g+(d).log.xz

006028059.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028059.td-b3lyp_6-31+g(d).gjf (generated)

006028059.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028059.mol 006028059.PUBCHEM 006028059.mol (via Jmol)
006028080.b3lyp_6-31g(d).inp

006028080.b3lyp_6-31g(d).qchem.inp (generated)

006028080.b3lyp_6-31g(d).gjf (generated)

006028080.b3lyp_6-31g(d).firefly.inp (generated)

006028080.b3lyp_6-31g(d).smash.inp (generated)

006028080.b3lyp_6-31g(d).nwchem.inp (generated) 006028080.b3lyp_6-31g(d).log.xz 006028080.td-b3lyp_6-31g+(d).inp 006028080.td-b3lyp_6-31g+(d).log.xz

006028080.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028080.td-b3lyp_6-31+g(d).gjf (generated)

006028080.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028080.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028080.mol 006028080.PUBCHEM 006028080.mol (via Jmol)
006028137.b3lyp_6-31g(d).inp

006028137.b3lyp_6-31g(d).qchem.inp (generated)

006028137.b3lyp_6-31g(d).gjf (generated)

006028137.b3lyp_6-31g(d).firefly.inp (generated)

006028137.b3lyp_6-31g(d).smash.inp (generated)

006028137.b3lyp_6-31g(d).nwchem.inp (generated) 006028137.b3lyp_6-31g(d).log.xz 006028137.mol 006028137.PUBCHEM 006028137.mol (via Jmol)
006028264.b3lyp_6-31g(d).inp

006028264.b3lyp_6-31g(d).qchem.inp (generated)

006028264.b3lyp_6-31g(d).gjf (generated)

006028264.b3lyp_6-31g(d).firefly.inp (generated)

006028264.b3lyp_6-31g(d).smash.inp (generated)

006028264.b3lyp_6-31g(d).nwchem.inp (generated) 006028264.b3lyp_6-31g(d).log.xz 006028264.td-b3lyp_6-31g+(d).inp 006028264.td-b3lyp_6-31g+(d).log.xz

006028264.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028264.td-b3lyp_6-31+g(d).gjf (generated)

006028264.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028264.mol 006028264.PUBCHEM 006028264.mol (via Jmol)
006028342.b3lyp_6-31g(d).inp

006028342.b3lyp_6-31g(d).qchem.inp (generated)

006028342.b3lyp_6-31g(d).gjf (generated)

006028342.b3lyp_6-31g(d).firefly.inp (generated)

006028342.b3lyp_6-31g(d).smash.inp (generated)

006028342.b3lyp_6-31g(d).nwchem.inp (generated) 006028342.b3lyp_6-31g(d).log.xz 006028342.td-b3lyp_6-31g+(d).inp 006028342.td-b3lyp_6-31g+(d).log.xz

006028342.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028342.td-b3lyp_6-31+g(d).gjf (generated)

006028342.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028342.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028342.mol 006028342.PUBCHEM 006028342.mol (via Jmol)
006028424.b3lyp_6-31g(d).inp

006028424.b3lyp_6-31g(d).qchem.inp (generated)

006028424.b3lyp_6-31g(d).gjf (generated)

006028424.b3lyp_6-31g(d).firefly.inp (generated)

006028424.b3lyp_6-31g(d).smash.inp (generated)

006028424.b3lyp_6-31g(d).nwchem.inp (generated) 006028424.b3lyp_6-31g(d).log.xz 006028424.td-b3lyp_6-31g+(d).inp 006028424.td-b3lyp_6-31g+(d).log.xz

006028424.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028424.td-b3lyp_6-31+g(d).gjf (generated)

006028424.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028424.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028424.mol 006028424.PUBCHEM 006028424.mol (via Jmol)
006028436.b3lyp_6-31g(d).inp

006028436.b3lyp_6-31g(d).qchem.inp (generated)

006028436.b3lyp_6-31g(d).gjf (generated)

006028436.b3lyp_6-31g(d).firefly.inp (generated)

006028436.b3lyp_6-31g(d).smash.inp (generated)

006028436.b3lyp_6-31g(d).nwchem.inp (generated) 006028436.b3lyp_6-31g(d).log.xz 006028436.td-b3lyp_6-31g+(d).inp 006028436.td-b3lyp_6-31g+(d).log.xz

006028436.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028436.td-b3lyp_6-31+g(d).gjf (generated)

006028436.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028436.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028436.mol 006028436.PUBCHEM 006028436.mol (via Jmol)
006028462.b3lyp_6-31g(d).inp

006028462.b3lyp_6-31g(d).qchem.inp (generated)

006028462.b3lyp_6-31g(d).gjf (generated)

006028462.b3lyp_6-31g(d).firefly.inp (generated)

006028462.b3lyp_6-31g(d).smash.inp (generated)

006028462.b3lyp_6-31g(d).nwchem.inp (generated) 006028462.b3lyp_6-31g(d).log.xz 006028462.td-b3lyp_6-31g+(d).inp 006028462.td-b3lyp_6-31g+(d).log.xz

006028462.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028462.td-b3lyp_6-31+g(d).gjf (generated)

006028462.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028462.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028462.mol 006028462.PUBCHEM 006028462.mol (via Jmol)
006028468.b3lyp_6-31g(d).inp

006028468.b3lyp_6-31g(d).qchem.inp (generated)

006028468.b3lyp_6-31g(d).gjf (generated)

006028468.b3lyp_6-31g(d).firefly.inp (generated)

006028468.b3lyp_6-31g(d).smash.inp (generated)

006028468.b3lyp_6-31g(d).nwchem.inp (generated) 006028468.b3lyp_6-31g(d).log.xz 006028468.td-b3lyp_6-31g+(d).inp 006028468.td-b3lyp_6-31g+(d).log.xz

006028468.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028468.td-b3lyp_6-31+g(d).gjf (generated)

006028468.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028468.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028468.mol 006028468.PUBCHEM 006028468.mol (via Jmol)
006028494.b3lyp_6-31g(d).inp

006028494.b3lyp_6-31g(d).qchem.inp (generated)

006028494.b3lyp_6-31g(d).gjf (generated)

006028494.b3lyp_6-31g(d).firefly.inp (generated)

006028494.b3lyp_6-31g(d).smash.inp (generated)

006028494.b3lyp_6-31g(d).nwchem.inp (generated) 006028494.b3lyp_6-31g(d).log.xz 006028494.td-b3lyp_6-31g+(d).inp 006028494.td-b3lyp_6-31g+(d).log.xz

006028494.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028494.td-b3lyp_6-31+g(d).gjf (generated)

006028494.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028494.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028494.mol 006028494.PUBCHEM 006028494.mol (via Jmol)
006028531.b3lyp_6-31g(d).inp

006028531.b3lyp_6-31g(d).qchem.inp (generated)

006028531.b3lyp_6-31g(d).gjf (generated)

006028531.b3lyp_6-31g(d).firefly.inp (generated)

006028531.b3lyp_6-31g(d).smash.inp (generated)

006028531.b3lyp_6-31g(d).nwchem.inp (generated) 006028531.b3lyp_6-31g(d).log.xz 006028531.td-b3lyp_6-31g+(d).inp 006028531.td-b3lyp_6-31g+(d).log.xz

006028531.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028531.td-b3lyp_6-31+g(d).gjf (generated)

006028531.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028531.mol 006028531.PUBCHEM 006028531.mol (via Jmol)
006028556.b3lyp_6-31g(d).inp

006028556.b3lyp_6-31g(d).qchem.inp (generated)

006028556.b3lyp_6-31g(d).gjf (generated)

006028556.b3lyp_6-31g(d).firefly.inp (generated)

006028556.b3lyp_6-31g(d).smash.inp (generated)

006028556.b3lyp_6-31g(d).nwchem.inp (generated) 006028556.b3lyp_6-31g(d).log.xz 006028556.td-b3lyp_6-31g+(d).inp 006028556.td-b3lyp_6-31g+(d).log.xz

006028556.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028556.td-b3lyp_6-31+g(d).gjf (generated)

006028556.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028556.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028556.mol 006028556.PUBCHEM 006028556.mol (via Jmol)
006028584.b3lyp_6-31g(d).inp

006028584.b3lyp_6-31g(d).qchem.inp (generated)

006028584.b3lyp_6-31g(d).gjf (generated)

006028584.b3lyp_6-31g(d).firefly.inp (generated)

006028584.b3lyp_6-31g(d).smash.inp (generated)

006028584.b3lyp_6-31g(d).nwchem.inp (generated) 006028584.b3lyp_6-31g(d).log.xz 006028584.td-b3lyp_6-31g+(d).inp 006028584.td-b3lyp_6-31g+(d).log.xz

006028584.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028584.td-b3lyp_6-31+g(d).gjf (generated)

006028584.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028584.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028584.mol 006028584.PUBCHEM 006028584.mol (via Jmol)
006028672.b3lyp_6-31g(d).inp

006028672.b3lyp_6-31g(d).qchem.inp (generated)

006028672.b3lyp_6-31g(d).gjf (generated)

006028672.b3lyp_6-31g(d).firefly.inp (generated)

006028672.b3lyp_6-31g(d).smash.inp (generated)

006028672.b3lyp_6-31g(d).nwchem.inp (generated) 006028672.b3lyp_6-31g(d).log.xz 006028672.td-b3lyp_6-31g+(d).inp 006028672.td-b3lyp_6-31g+(d).log.xz

006028672.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028672.td-b3lyp_6-31+g(d).gjf (generated)

006028672.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028672.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028672.mol 006028672.PUBCHEM 006028672.mol (via Jmol)
006028674.b3lyp_6-31g(d).inp

006028674.b3lyp_6-31g(d).qchem.inp (generated)

006028674.b3lyp_6-31g(d).gjf (generated)

006028674.b3lyp_6-31g(d).firefly.inp (generated)

006028674.b3lyp_6-31g(d).smash.inp (generated)

006028674.b3lyp_6-31g(d).nwchem.inp (generated) 006028674.b3lyp_6-31g(d).log.xz 006028674.td-b3lyp_6-31g+(d).inp 006028674.td-b3lyp_6-31g+(d).log.xz

006028674.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028674.td-b3lyp_6-31+g(d).gjf (generated)

006028674.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028674.mol 006028674.PUBCHEM 006028674.mol (via Jmol)
006028739.b3lyp_6-31g(d).inp

006028739.b3lyp_6-31g(d).qchem.inp (generated)

006028739.b3lyp_6-31g(d).gjf (generated)

006028739.b3lyp_6-31g(d).firefly.inp (generated)

006028739.b3lyp_6-31g(d).smash.inp (generated)

006028739.b3lyp_6-31g(d).nwchem.inp (generated) 006028739.b3lyp_6-31g(d).log.xz 006028739.td-b3lyp_6-31g+(d).inp 006028739.td-b3lyp_6-31g+(d).log.xz

006028739.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028739.td-b3lyp_6-31+g(d).gjf (generated)

006028739.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028739.mol 006028739.PUBCHEM 006028739.mol (via Jmol)
006028793.b3lyp_6-31g(d).inp

006028793.b3lyp_6-31g(d).qchem.inp (generated)

006028793.b3lyp_6-31g(d).gjf (generated)

006028793.b3lyp_6-31g(d).firefly.inp (generated)

006028793.b3lyp_6-31g(d).smash.inp (generated)

006028793.b3lyp_6-31g(d).nwchem.inp (generated) 006028793.b3lyp_6-31g(d).log.xz 006028793.td-b3lyp_6-31g+(d).inp 006028793.td-b3lyp_6-31g+(d).log.xz

006028793.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028793.td-b3lyp_6-31+g(d).gjf (generated)

006028793.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028793.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028793.mol 006028793.PUBCHEM 006028793.mol (via Jmol)
006028831.b3lyp_6-31g(d).inp

006028831.b3lyp_6-31g(d).qchem.inp (generated)

006028831.b3lyp_6-31g(d).gjf (generated)

006028831.b3lyp_6-31g(d).firefly.inp (generated)

006028831.b3lyp_6-31g(d).smash.inp (generated)

006028831.b3lyp_6-31g(d).nwchem.inp (generated) 006028831.b3lyp_6-31g(d).log.xz 006028831.td-b3lyp_6-31g+(d).inp 006028831.td-b3lyp_6-31g+(d).log.xz

006028831.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028831.td-b3lyp_6-31+g(d).gjf (generated)

006028831.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028831.mol 006028831.PUBCHEM 006028831.mol (via Jmol)
006028849.b3lyp_6-31g(d).inp

006028849.b3lyp_6-31g(d).qchem.inp (generated)

006028849.b3lyp_6-31g(d).gjf (generated)

006028849.b3lyp_6-31g(d).firefly.inp (generated)

006028849.b3lyp_6-31g(d).smash.inp (generated)

006028849.b3lyp_6-31g(d).nwchem.inp (generated) 006028849.b3lyp_6-31g(d).log.xz 006028849.td-b3lyp_6-31g+(d).inp 006028849.td-b3lyp_6-31g+(d).log.xz

006028849.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028849.td-b3lyp_6-31+g(d).gjf (generated)

006028849.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028849.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028849.mol 006028849.PUBCHEM 006028849.mol (via Jmol)
006028867.b3lyp_6-31g(d).inp

006028867.b3lyp_6-31g(d).qchem.inp (generated)

006028867.b3lyp_6-31g(d).gjf (generated)

006028867.b3lyp_6-31g(d).firefly.inp (generated)

006028867.b3lyp_6-31g(d).smash.inp (generated)

006028867.b3lyp_6-31g(d).nwchem.inp (generated) 006028867.b3lyp_6-31g(d).log.xz 006028867.td-b3lyp_6-31g+(d).inp 006028867.td-b3lyp_6-31g+(d).log.xz

006028867.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028867.td-b3lyp_6-31+g(d).gjf (generated)

006028867.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028867.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028867.mol 006028867.PUBCHEM 006028867.mol (via Jmol)
006028875.b3lyp_6-31g(d).inp

006028875.b3lyp_6-31g(d).qchem.inp (generated)

006028875.b3lyp_6-31g(d).gjf (generated)

006028875.b3lyp_6-31g(d).firefly.inp (generated)

006028875.b3lyp_6-31g(d).smash.inp (generated)

006028875.b3lyp_6-31g(d).nwchem.inp (generated) 006028875.b3lyp_6-31g(d).log.xz 006028875.td-b3lyp_6-31g+(d).inp 006028875.td-b3lyp_6-31g+(d).log.xz

006028875.td-b3lyp_6-31+g(d).qchem.inp (generated)

006028875.td-b3lyp_6-31+g(d).gjf (generated)

006028875.td-b3lyp_6-31+g(d).firefly.inp (generated)

006028875.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006028875.mol 006028875.PUBCHEM 006028875.mol (via Jmol)
006029003.b3lyp_6-31g(d).inp

006029003.b3lyp_6-31g(d).qchem.inp (generated)

006029003.b3lyp_6-31g(d).gjf (generated)

006029003.b3lyp_6-31g(d).firefly.inp (generated)

006029003.b3lyp_6-31g(d).smash.inp (generated)

006029003.b3lyp_6-31g(d).nwchem.inp (generated) 006029003.b3lyp_6-31g(d).log.xz 006029003.td-b3lyp_6-31g+(d).inp 006029003.td-b3lyp_6-31g+(d).log.xz

006029003.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029003.td-b3lyp_6-31+g(d).gjf (generated)

006029003.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029003.mol 006029003.PUBCHEM 006029003.mol (via Jmol)
006029115.b3lyp_6-31g(d).inp

006029115.b3lyp_6-31g(d).qchem.inp (generated)

006029115.b3lyp_6-31g(d).gjf (generated)

006029115.b3lyp_6-31g(d).firefly.inp (generated)

006029115.b3lyp_6-31g(d).smash.inp (generated)

006029115.b3lyp_6-31g(d).nwchem.inp (generated) 006029115.b3lyp_6-31g(d).log.xz 006029115.td-b3lyp_6-31g+(d).inp 006029115.td-b3lyp_6-31g+(d).log.xz

006029115.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029115.td-b3lyp_6-31+g(d).gjf (generated)

006029115.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029115.mol 006029115.PUBCHEM 006029115.mol (via Jmol)
006029162.b3lyp_6-31g(d).inp

006029162.b3lyp_6-31g(d).qchem.inp (generated)

006029162.b3lyp_6-31g(d).gjf (generated)

006029162.b3lyp_6-31g(d).firefly.inp (generated)

006029162.b3lyp_6-31g(d).smash.inp (generated)

006029162.b3lyp_6-31g(d).nwchem.inp (generated) 006029162.b3lyp_6-31g(d).log.xz 006029162.td-b3lyp_6-31g+(d).inp 006029162.td-b3lyp_6-31g+(d).log.xz

006029162.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029162.td-b3lyp_6-31+g(d).gjf (generated)

006029162.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029162.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029162.mol 006029162.PUBCHEM 006029162.mol (via Jmol)
006029164.b3lyp_6-31g(d).inp

006029164.b3lyp_6-31g(d).qchem.inp (generated)

006029164.b3lyp_6-31g(d).gjf (generated)

006029164.b3lyp_6-31g(d).firefly.inp (generated)

006029164.b3lyp_6-31g(d).smash.inp (generated)

006029164.b3lyp_6-31g(d).nwchem.inp (generated) 006029164.b3lyp_6-31g(d).log.xz 006029164.td-b3lyp_6-31g+(d).inp 006029164.td-b3lyp_6-31g+(d).log.xz

006029164.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029164.td-b3lyp_6-31+g(d).gjf (generated)

006029164.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029164.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029164.mol 006029164.PUBCHEM 006029164.mol (via Jmol)
006029448.b3lyp_6-31g(d).inp

006029448.b3lyp_6-31g(d).qchem.inp (generated)

006029448.b3lyp_6-31g(d).gjf (generated)

006029448.b3lyp_6-31g(d).firefly.inp (generated)

006029448.b3lyp_6-31g(d).smash.inp (generated)

006029448.b3lyp_6-31g(d).nwchem.inp (generated) 006029448.b3lyp_6-31g(d).log.xz 006029448.mol 006029448.PUBCHEM 006029448.mol (via Jmol)
006029456.b3lyp_6-31g(d).inp

006029456.b3lyp_6-31g(d).qchem.inp (generated)

006029456.b3lyp_6-31g(d).gjf (generated)

006029456.b3lyp_6-31g(d).firefly.inp (generated)

006029456.b3lyp_6-31g(d).smash.inp (generated)

006029456.b3lyp_6-31g(d).nwchem.inp (generated) 006029456.b3lyp_6-31g(d).log.xz 006029456.td-b3lyp_6-31g+(d).inp 006029456.td-b3lyp_6-31g+(d).log.xz

006029456.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029456.td-b3lyp_6-31+g(d).gjf (generated)

006029456.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029456.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029456.mol 006029456.PUBCHEM 006029456.mol (via Jmol)
006029586.b3lyp_6-31g(d).inp

006029586.b3lyp_6-31g(d).qchem.inp (generated)

006029586.b3lyp_6-31g(d).gjf (generated)

006029586.b3lyp_6-31g(d).firefly.inp (generated)

006029586.b3lyp_6-31g(d).smash.inp (generated)

006029586.b3lyp_6-31g(d).nwchem.inp (generated) 006029586.b3lyp_6-31g(d).log.xz 006029586.mol 006029586.PUBCHEM 006029586.mol (via Jmol)
006029648.b3lyp_6-31g(d).inp

006029648.b3lyp_6-31g(d).qchem.inp (generated)

006029648.b3lyp_6-31g(d).gjf (generated)

006029648.b3lyp_6-31g(d).firefly.inp (generated)

006029648.b3lyp_6-31g(d).smash.inp (generated)

006029648.b3lyp_6-31g(d).nwchem.inp (generated) 006029648.b3lyp_6-31g(d).log.xz 006029648.td-b3lyp_6-31g+(d).inp 006029648.td-b3lyp_6-31g+(d).log.xz

006029648.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029648.td-b3lyp_6-31+g(d).gjf (generated)

006029648.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029648.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029648.mol 006029648.PUBCHEM 006029648.mol (via Jmol)
006029649.b3lyp_6-31g(d).inp

006029649.b3lyp_6-31g(d).qchem.inp (generated)

006029649.b3lyp_6-31g(d).gjf (generated)

006029649.b3lyp_6-31g(d).firefly.inp (generated)

006029649.b3lyp_6-31g(d).smash.inp (generated)

006029649.b3lyp_6-31g(d).nwchem.inp (generated) 006029649.b3lyp_6-31g(d).log.xz 006029649.td-b3lyp_6-31g+(d).inp 006029649.td-b3lyp_6-31g+(d).log.xz

006029649.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029649.td-b3lyp_6-31+g(d).gjf (generated)

006029649.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029649.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029649.mol 006029649.PUBCHEM 006029649.mol (via Jmol)
006029663.b3lyp_6-31g(d).inp

006029663.b3lyp_6-31g(d).qchem.inp (generated)

006029663.b3lyp_6-31g(d).gjf (generated)

006029663.b3lyp_6-31g(d).firefly.inp (generated)

006029663.b3lyp_6-31g(d).smash.inp (generated)

006029663.b3lyp_6-31g(d).nwchem.inp (generated) 006029663.b3lyp_6-31g(d).log.xz 006029663.td-b3lyp_6-31g+(d).inp 006029663.td-b3lyp_6-31g+(d).log.xz

006029663.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029663.td-b3lyp_6-31+g(d).gjf (generated)

006029663.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029663.mol 006029663.PUBCHEM 006029663.mol (via Jmol)
006029670.b3lyp_6-31g(d).inp

006029670.b3lyp_6-31g(d).qchem.inp (generated)

006029670.b3lyp_6-31g(d).gjf (generated)

006029670.b3lyp_6-31g(d).firefly.inp (generated)

006029670.b3lyp_6-31g(d).smash.inp (generated)

006029670.b3lyp_6-31g(d).nwchem.inp (generated) 006029670.b3lyp_6-31g(d).log.xz 006029670.td-b3lyp_6-31g+(d).inp 006029670.td-b3lyp_6-31g+(d).log.xz

006029670.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029670.td-b3lyp_6-31+g(d).gjf (generated)

006029670.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029670.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029670.mol 006029670.PUBCHEM 006029670.mol (via Jmol)
006029773.b3lyp_6-31g(d).inp

006029773.b3lyp_6-31g(d).qchem.inp (generated)

006029773.b3lyp_6-31g(d).gjf (generated)

006029773.b3lyp_6-31g(d).firefly.inp (generated)

006029773.b3lyp_6-31g(d).smash.inp (generated)

006029773.b3lyp_6-31g(d).nwchem.inp (generated) 006029773.b3lyp_6-31g(d).log.xz 006029773.td-b3lyp_6-31g+(d).inp 006029773.td-b3lyp_6-31g+(d).log.xz

006029773.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029773.td-b3lyp_6-31+g(d).gjf (generated)

006029773.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029773.mol 006029773.PUBCHEM 006029773.mol (via Jmol)
006029854.b3lyp_6-31g(d).inp

006029854.b3lyp_6-31g(d).qchem.inp (generated)

006029854.b3lyp_6-31g(d).gjf (generated)

006029854.b3lyp_6-31g(d).firefly.inp (generated)

006029854.b3lyp_6-31g(d).smash.inp (generated)

006029854.b3lyp_6-31g(d).nwchem.inp (generated) 006029854.b3lyp_6-31g(d).log.xz 006029854.td-b3lyp_6-31g+(d).inp 006029854.td-b3lyp_6-31g+(d).log.xz

006029854.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029854.td-b3lyp_6-31+g(d).gjf (generated)

006029854.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029854.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029854.mol 006029854.PUBCHEM 006029854.mol (via Jmol)
006029905.b3lyp_6-31g(d).inp

006029905.b3lyp_6-31g(d).qchem.inp (generated)

006029905.b3lyp_6-31g(d).gjf (generated)

006029905.b3lyp_6-31g(d).firefly.inp (generated)

006029905.b3lyp_6-31g(d).smash.inp (generated)

006029905.b3lyp_6-31g(d).nwchem.inp (generated) 006029905.b3lyp_6-31g(d).log.xz 006029905.mol 006029905.PUBCHEM 006029905.mol (via Jmol)
006029910.b3lyp_6-31g(d).inp

006029910.b3lyp_6-31g(d).qchem.inp (generated)

006029910.b3lyp_6-31g(d).gjf (generated)

006029910.b3lyp_6-31g(d).firefly.inp (generated)

006029910.b3lyp_6-31g(d).smash.inp (generated)

006029910.b3lyp_6-31g(d).nwchem.inp (generated) 006029910.b3lyp_6-31g(d).log.xz 006029910.td-b3lyp_6-31g+(d).inp 006029910.td-b3lyp_6-31g+(d).log.xz

006029910.td-b3lyp_6-31+g(d).qchem.inp (generated)

006029910.td-b3lyp_6-31+g(d).gjf (generated)

006029910.td-b3lyp_6-31+g(d).firefly.inp (generated)

006029910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006029910.mol 006029910.PUBCHEM 006029910.mol (via Jmol)
006030137.b3lyp_6-31g(d).inp

006030137.b3lyp_6-31g(d).qchem.inp (generated)

006030137.b3lyp_6-31g(d).gjf (generated)

006030137.b3lyp_6-31g(d).firefly.inp (generated)

006030137.b3lyp_6-31g(d).smash.inp (generated)

006030137.b3lyp_6-31g(d).nwchem.inp (generated) 006030137.b3lyp_6-31g(d).log.xz 006030137.td-b3lyp_6-31g+(d).inp 006030137.td-b3lyp_6-31g+(d).log.xz

006030137.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030137.td-b3lyp_6-31+g(d).gjf (generated)

006030137.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030137.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030137.mol 006030137.PUBCHEM 006030137.mol (via Jmol)
006030310.b3lyp_6-31g(d).inp

006030310.b3lyp_6-31g(d).qchem.inp (generated)

006030310.b3lyp_6-31g(d).gjf (generated)

006030310.b3lyp_6-31g(d).firefly.inp (generated)

006030310.b3lyp_6-31g(d).smash.inp (generated)

006030310.b3lyp_6-31g(d).nwchem.inp (generated) 006030310.b3lyp_6-31g(d).log.xz 006030310.mol 006030310.PUBCHEM 006030310.mol (via Jmol)
006030359.b3lyp_6-31g(d).inp

006030359.b3lyp_6-31g(d).qchem.inp (generated)

006030359.b3lyp_6-31g(d).gjf (generated)

006030359.b3lyp_6-31g(d).firefly.inp (generated)

006030359.b3lyp_6-31g(d).smash.inp (generated)

006030359.b3lyp_6-31g(d).nwchem.inp (generated) 006030359.b3lyp_6-31g(d).log.xz 006030359.td-b3lyp_6-31g+(d).inp 006030359.td-b3lyp_6-31g+(d).log.xz

006030359.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030359.td-b3lyp_6-31+g(d).gjf (generated)

006030359.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030359.mol 006030359.PUBCHEM 006030359.mol (via Jmol)
006030427.b3lyp_6-31g(d).inp

006030427.b3lyp_6-31g(d).qchem.inp (generated)

006030427.b3lyp_6-31g(d).gjf (generated)

006030427.b3lyp_6-31g(d).firefly.inp (generated)

006030427.b3lyp_6-31g(d).smash.inp (generated)

006030427.b3lyp_6-31g(d).nwchem.inp (generated) 006030427.b3lyp_6-31g(d).log.xz 006030427.td-b3lyp_6-31g+(d).inp 006030427.td-b3lyp_6-31g+(d).log.xz

006030427.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030427.td-b3lyp_6-31+g(d).gjf (generated)

006030427.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030427.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030427.mol 006030427.PUBCHEM 006030427.mol (via Jmol)
006030434.b3lyp_6-31g(d).inp

006030434.b3lyp_6-31g(d).qchem.inp (generated)

006030434.b3lyp_6-31g(d).gjf (generated)

006030434.b3lyp_6-31g(d).firefly.inp (generated)

006030434.b3lyp_6-31g(d).smash.inp (generated)

006030434.b3lyp_6-31g(d).nwchem.inp (generated) 006030434.b3lyp_6-31g(d).log.xz 006030434.mol 006030434.PUBCHEM 006030434.mol (via Jmol)
006030461.b3lyp_6-31g(d).inp

006030461.b3lyp_6-31g(d).qchem.inp (generated)

006030461.b3lyp_6-31g(d).gjf (generated)

006030461.b3lyp_6-31g(d).firefly.inp (generated)

006030461.b3lyp_6-31g(d).smash.inp (generated)

006030461.b3lyp_6-31g(d).nwchem.inp (generated) 006030461.b3lyp_6-31g(d).log.xz 006030461.mol 006030461.PUBCHEM 006030461.mol (via Jmol)
006030587.b3lyp_6-31g(d).inp

006030587.b3lyp_6-31g(d).qchem.inp (generated)

006030587.b3lyp_6-31g(d).gjf (generated)

006030587.b3lyp_6-31g(d).firefly.inp (generated)

006030587.b3lyp_6-31g(d).smash.inp (generated)

006030587.b3lyp_6-31g(d).nwchem.inp (generated) 006030587.b3lyp_6-31g(d).log.xz 006030587.td-b3lyp_6-31g+(d).inp 006030587.td-b3lyp_6-31g+(d).log.xz

006030587.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030587.td-b3lyp_6-31+g(d).gjf (generated)

006030587.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030587.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030587.mol 006030587.PUBCHEM 006030587.mol (via Jmol)
006030637.b3lyp_6-31g(d).inp

006030637.b3lyp_6-31g(d).qchem.inp (generated)

006030637.b3lyp_6-31g(d).gjf (generated)

006030637.b3lyp_6-31g(d).firefly.inp (generated)

006030637.b3lyp_6-31g(d).smash.inp (generated)

006030637.b3lyp_6-31g(d).nwchem.inp (generated) 006030637.b3lyp_6-31g(d).log.xz 006030637.td-b3lyp_6-31g+(d).inp 006030637.td-b3lyp_6-31g+(d).log.xz

006030637.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030637.td-b3lyp_6-31+g(d).gjf (generated)

006030637.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030637.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030637.mol 006030637.PUBCHEM 006030637.mol (via Jmol)
006030711.b3lyp_6-31g(d).inp

006030711.b3lyp_6-31g(d).qchem.inp (generated)

006030711.b3lyp_6-31g(d).gjf (generated)

006030711.b3lyp_6-31g(d).firefly.inp (generated)

006030711.b3lyp_6-31g(d).smash.inp (generated)

006030711.b3lyp_6-31g(d).nwchem.inp (generated) 006030711.b3lyp_6-31g(d).log.xz 006030711.td-b3lyp_6-31g+(d).inp 006030711.td-b3lyp_6-31g+(d).log.xz

006030711.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030711.td-b3lyp_6-31+g(d).gjf (generated)

006030711.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030711.mol 006030711.PUBCHEM 006030711.mol (via Jmol)
006030812.b3lyp_6-31g(d).inp

006030812.b3lyp_6-31g(d).qchem.inp (generated)

006030812.b3lyp_6-31g(d).gjf (generated)

006030812.b3lyp_6-31g(d).firefly.inp (generated)

006030812.b3lyp_6-31g(d).smash.inp (generated)

006030812.b3lyp_6-31g(d).nwchem.inp (generated) 006030812.b3lyp_6-31g(d).log.xz 006030812.td-b3lyp_6-31g+(d).inp 006030812.td-b3lyp_6-31g+(d).log.xz

006030812.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030812.td-b3lyp_6-31+g(d).gjf (generated)

006030812.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030812.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030812.mol 006030812.PUBCHEM 006030812.mol (via Jmol)
006030904.b3lyp_6-31g(d).inp

006030904.b3lyp_6-31g(d).qchem.inp (generated)

006030904.b3lyp_6-31g(d).gjf (generated)

006030904.b3lyp_6-31g(d).firefly.inp (generated)

006030904.b3lyp_6-31g(d).smash.inp (generated)

006030904.b3lyp_6-31g(d).nwchem.inp (generated) 006030904.b3lyp_6-31g(d).log.xz 006030904.td-b3lyp_6-31g+(d).inp 006030904.td-b3lyp_6-31g+(d).log.xz

006030904.td-b3lyp_6-31+g(d).qchem.inp (generated)

006030904.td-b3lyp_6-31+g(d).gjf (generated)

006030904.td-b3lyp_6-31+g(d).firefly.inp (generated)

006030904.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006030904.mol 006030904.PUBCHEM 006030904.mol (via Jmol)
006031115.b3lyp_6-31g(d).inp

006031115.b3lyp_6-31g(d).qchem.inp (generated)

006031115.b3lyp_6-31g(d).gjf (generated)

006031115.b3lyp_6-31g(d).firefly.inp (generated)

006031115.b3lyp_6-31g(d).smash.inp (generated)

006031115.b3lyp_6-31g(d).nwchem.inp (generated) 006031115.b3lyp_6-31g(d).log.xz 006031115.td-b3lyp_6-31g+(d).inp 006031115.td-b3lyp_6-31g+(d).log.xz

006031115.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031115.td-b3lyp_6-31+g(d).gjf (generated)

006031115.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031115.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031115.mol 006031115.PUBCHEM 006031115.mol (via Jmol)
006031251.b3lyp_6-31g(d).inp

006031251.b3lyp_6-31g(d).qchem.inp (generated)

006031251.b3lyp_6-31g(d).gjf (generated)

006031251.b3lyp_6-31g(d).firefly.inp (generated)

006031251.b3lyp_6-31g(d).smash.inp (generated)

006031251.b3lyp_6-31g(d).nwchem.inp (generated) 006031251.b3lyp_6-31g(d).log.xz 006031251.td-b3lyp_6-31g+(d).inp 006031251.td-b3lyp_6-31g+(d).log.xz

006031251.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031251.td-b3lyp_6-31+g(d).gjf (generated)

006031251.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031251.mol 006031251.PUBCHEM 006031251.mol (via Jmol)
006031257.b3lyp_6-31g(d).inp

006031257.b3lyp_6-31g(d).qchem.inp (generated)

006031257.b3lyp_6-31g(d).gjf (generated)

006031257.b3lyp_6-31g(d).firefly.inp (generated)

006031257.b3lyp_6-31g(d).smash.inp (generated)

006031257.b3lyp_6-31g(d).nwchem.inp (generated) 006031257.b3lyp_6-31g(d).log.xz 006031257.td-b3lyp_6-31g+(d).inp 006031257.td-b3lyp_6-31g+(d).log.xz

006031257.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031257.td-b3lyp_6-31+g(d).gjf (generated)

006031257.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031257.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031257.mol 006031257.PUBCHEM 006031257.mol (via Jmol)
006031359.b3lyp_6-31g(d).inp

006031359.b3lyp_6-31g(d).qchem.inp (generated)

006031359.b3lyp_6-31g(d).gjf (generated)

006031359.b3lyp_6-31g(d).firefly.inp (generated)

006031359.b3lyp_6-31g(d).smash.inp (generated)

006031359.b3lyp_6-31g(d).nwchem.inp (generated) 006031359.b3lyp_6-31g(d).log.xz 006031359.td-b3lyp_6-31g+(d).inp 006031359.td-b3lyp_6-31g+(d).log.xz

006031359.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031359.td-b3lyp_6-31+g(d).gjf (generated)

006031359.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031359.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031359.mol 006031359.PUBCHEM 006031359.mol (via Jmol)
006031360.b3lyp_6-31g(d).inp

006031360.b3lyp_6-31g(d).qchem.inp (generated)

006031360.b3lyp_6-31g(d).gjf (generated)

006031360.b3lyp_6-31g(d).firefly.inp (generated)

006031360.b3lyp_6-31g(d).smash.inp (generated)

006031360.b3lyp_6-31g(d).nwchem.inp (generated) 006031360.b3lyp_6-31g(d).log.xz 006031360.mol 006031360.PUBCHEM 006031360.mol (via Jmol)
006031416.b3lyp_6-31g(d).inp

006031416.b3lyp_6-31g(d).qchem.inp (generated)

006031416.b3lyp_6-31g(d).gjf (generated)

006031416.b3lyp_6-31g(d).firefly.inp (generated)

006031416.b3lyp_6-31g(d).smash.inp (generated)

006031416.b3lyp_6-31g(d).nwchem.inp (generated) 006031416.b3lyp_6-31g(d).log.xz 006031416.td-b3lyp_6-31g+(d).inp 006031416.td-b3lyp_6-31g+(d).log.xz

006031416.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031416.td-b3lyp_6-31+g(d).gjf (generated)

006031416.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031416.mol 006031416.PUBCHEM 006031416.mol (via Jmol)
006031489.b3lyp_6-31g(d).inp

006031489.b3lyp_6-31g(d).qchem.inp (generated)

006031489.b3lyp_6-31g(d).gjf (generated)

006031489.b3lyp_6-31g(d).firefly.inp (generated)

006031489.b3lyp_6-31g(d).smash.inp (generated)

006031489.b3lyp_6-31g(d).nwchem.inp (generated) 006031489.b3lyp_6-31g(d).log.xz 006031489.td-b3lyp_6-31g+(d).inp 006031489.td-b3lyp_6-31g+(d).log.xz

006031489.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031489.td-b3lyp_6-31+g(d).gjf (generated)

006031489.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031489.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031489.mol 006031489.PUBCHEM 006031489.mol (via Jmol)
006031668.b3lyp_6-31g(d).inp

006031668.b3lyp_6-31g(d).qchem.inp (generated)

006031668.b3lyp_6-31g(d).gjf (generated)

006031668.b3lyp_6-31g(d).firefly.inp (generated)

006031668.b3lyp_6-31g(d).smash.inp (generated)

006031668.b3lyp_6-31g(d).nwchem.inp (generated) 006031668.b3lyp_6-31g(d).log.xz 006031668.td-b3lyp_6-31g+(d).inp 006031668.td-b3lyp_6-31g+(d).log.xz

006031668.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031668.td-b3lyp_6-31+g(d).gjf (generated)

006031668.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031668.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031668.mol 006031668.PUBCHEM 006031668.mol (via Jmol)
006031669.b3lyp_6-31g(d).inp

006031669.b3lyp_6-31g(d).qchem.inp (generated)

006031669.b3lyp_6-31g(d).gjf (generated)

006031669.b3lyp_6-31g(d).firefly.inp (generated)

006031669.b3lyp_6-31g(d).smash.inp (generated)

006031669.b3lyp_6-31g(d).nwchem.inp (generated) 006031669.b3lyp_6-31g(d).log.xz 006031669.td-b3lyp_6-31g+(d).inp 006031669.td-b3lyp_6-31g+(d).log.xz

006031669.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031669.td-b3lyp_6-31+g(d).gjf (generated)

006031669.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031669.mol 006031669.PUBCHEM 006031669.mol (via Jmol)
006031871.b3lyp_6-31g(d).inp

006031871.b3lyp_6-31g(d).qchem.inp (generated)

006031871.b3lyp_6-31g(d).gjf (generated)

006031871.b3lyp_6-31g(d).firefly.inp (generated)

006031871.b3lyp_6-31g(d).smash.inp (generated)

006031871.b3lyp_6-31g(d).nwchem.inp (generated) 006031871.b3lyp_6-31g(d).log.xz 006031871.td-b3lyp_6-31g+(d).inp 006031871.td-b3lyp_6-31g+(d).log.xz

006031871.td-b3lyp_6-31+g(d).qchem.inp (generated)

006031871.td-b3lyp_6-31+g(d).gjf (generated)

006031871.td-b3lyp_6-31+g(d).firefly.inp (generated)

006031871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006031871.mol 006031871.PUBCHEM 006031871.mol (via Jmol)
006032060.b3lyp_6-31g(d).inp

006032060.b3lyp_6-31g(d).qchem.inp (generated)

006032060.b3lyp_6-31g(d).gjf (generated)

006032060.b3lyp_6-31g(d).firefly.inp (generated)

006032060.b3lyp_6-31g(d).smash.inp (generated)

006032060.b3lyp_6-31g(d).nwchem.inp (generated) 006032060.b3lyp_6-31g(d).log.xz 006032060.td-b3lyp_6-31g+(d).inp 006032060.td-b3lyp_6-31g+(d).log.xz

006032060.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032060.td-b3lyp_6-31+g(d).gjf (generated)

006032060.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032060.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032060.mol 006032060.PUBCHEM 006032060.mol (via Jmol)
006032244.b3lyp_6-31g(d).inp

006032244.b3lyp_6-31g(d).qchem.inp (generated)

006032244.b3lyp_6-31g(d).gjf (generated)

006032244.b3lyp_6-31g(d).firefly.inp (generated)

006032244.b3lyp_6-31g(d).smash.inp (generated)

006032244.b3lyp_6-31g(d).nwchem.inp (generated) 006032244.b3lyp_6-31g(d).log.xz 006032244.td-b3lyp_6-31g+(d).inp 006032244.td-b3lyp_6-31g+(d).log.xz

006032244.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032244.td-b3lyp_6-31+g(d).gjf (generated)

006032244.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032244.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032244.mol 006032244.PUBCHEM 006032244.mol (via Jmol)
006032245.b3lyp_6-31g(d).inp

006032245.b3lyp_6-31g(d).qchem.inp (generated)

006032245.b3lyp_6-31g(d).gjf (generated)

006032245.b3lyp_6-31g(d).firefly.inp (generated)

006032245.b3lyp_6-31g(d).smash.inp (generated)

006032245.b3lyp_6-31g(d).nwchem.inp (generated) 006032245.b3lyp_6-31g(d).log.xz 006032245.td-b3lyp_6-31g+(d).inp 006032245.td-b3lyp_6-31g+(d).log.xz

006032245.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032245.td-b3lyp_6-31+g(d).gjf (generated)

006032245.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032245.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032245.mol 006032245.PUBCHEM 006032245.mol (via Jmol)
006032251.b3lyp_6-31g(d).inp

006032251.b3lyp_6-31g(d).qchem.inp (generated)

006032251.b3lyp_6-31g(d).gjf (generated)

006032251.b3lyp_6-31g(d).firefly.inp (generated)

006032251.b3lyp_6-31g(d).smash.inp (generated)

006032251.b3lyp_6-31g(d).nwchem.inp (generated) 006032251.b3lyp_6-31g(d).log.xz 006032251.td-b3lyp_6-31g+(d).inp 006032251.td-b3lyp_6-31g+(d).log.xz

006032251.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032251.td-b3lyp_6-31+g(d).gjf (generated)

006032251.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032251.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032251.mol 006032251.PUBCHEM 006032251.mol (via Jmol)
006032297.b3lyp_6-31g(d).inp

006032297.b3lyp_6-31g(d).qchem.inp (generated)

006032297.b3lyp_6-31g(d).gjf (generated)

006032297.b3lyp_6-31g(d).firefly.inp (generated)

006032297.b3lyp_6-31g(d).smash.inp (generated)

006032297.b3lyp_6-31g(d).nwchem.inp (generated) 006032297.b3lyp_6-31g(d).log.xz 006032297.td-b3lyp_6-31g+(d).inp 006032297.td-b3lyp_6-31g+(d).log.xz

006032297.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032297.td-b3lyp_6-31+g(d).gjf (generated)

006032297.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032297.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032297.mol 006032297.PUBCHEM 006032297.mol (via Jmol)
006032298.b3lyp_6-31g(d).inp

006032298.b3lyp_6-31g(d).qchem.inp (generated)

006032298.b3lyp_6-31g(d).gjf (generated)

006032298.b3lyp_6-31g(d).firefly.inp (generated)

006032298.b3lyp_6-31g(d).smash.inp (generated)

006032298.b3lyp_6-31g(d).nwchem.inp (generated) 006032298.b3lyp_6-31g(d).log.xz 006032298.td-b3lyp_6-31g+(d).inp 006032298.td-b3lyp_6-31g+(d).log.xz

006032298.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032298.td-b3lyp_6-31+g(d).gjf (generated)

006032298.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032298.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032298.mol 006032298.PUBCHEM 006032298.mol (via Jmol)
006032332.b3lyp_6-31g(d).inp

006032332.b3lyp_6-31g(d).qchem.inp (generated)

006032332.b3lyp_6-31g(d).gjf (generated)

006032332.b3lyp_6-31g(d).firefly.inp (generated)

006032332.b3lyp_6-31g(d).smash.inp (generated)

006032332.b3lyp_6-31g(d).nwchem.inp (generated) 006032332.b3lyp_6-31g(d).log.xz 006032332.td-b3lyp_6-31g+(d).inp 006032332.td-b3lyp_6-31g+(d).log.xz

006032332.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032332.td-b3lyp_6-31+g(d).gjf (generated)

006032332.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032332.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032332.mol 006032332.PUBCHEM 006032332.mol (via Jmol)
006032335.b3lyp_6-31g(d).inp

006032335.b3lyp_6-31g(d).qchem.inp (generated)

006032335.b3lyp_6-31g(d).gjf (generated)

006032335.b3lyp_6-31g(d).firefly.inp (generated)

006032335.b3lyp_6-31g(d).smash.inp (generated)

006032335.b3lyp_6-31g(d).nwchem.inp (generated) 006032335.b3lyp_6-31g(d).log.xz 006032335.td-b3lyp_6-31g+(d).inp 006032335.td-b3lyp_6-31g+(d).log.xz

006032335.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032335.td-b3lyp_6-31+g(d).gjf (generated)

006032335.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032335.mol 006032335.PUBCHEM 006032335.mol (via Jmol)
006032412.b3lyp_6-31g(d).inp

006032412.b3lyp_6-31g(d).qchem.inp (generated)

006032412.b3lyp_6-31g(d).gjf (generated)

006032412.b3lyp_6-31g(d).firefly.inp (generated)

006032412.b3lyp_6-31g(d).smash.inp (generated)

006032412.b3lyp_6-31g(d).nwchem.inp (generated) 006032412.b3lyp_6-31g(d).log.xz 006032412.td-b3lyp_6-31g+(d).inp 006032412.td-b3lyp_6-31g+(d).log.xz

006032412.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032412.td-b3lyp_6-31+g(d).gjf (generated)

006032412.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032412.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032412.mol 006032412.PUBCHEM 006032412.mol (via Jmol)
006032532.b3lyp_6-31g(d).inp

006032532.b3lyp_6-31g(d).qchem.inp (generated)

006032532.b3lyp_6-31g(d).gjf (generated)

006032532.b3lyp_6-31g(d).firefly.inp (generated)

006032532.b3lyp_6-31g(d).smash.inp (generated)

006032532.b3lyp_6-31g(d).nwchem.inp (generated) 006032532.b3lyp_6-31g(d).log.xz 006032532.td-b3lyp_6-31g+(d).inp 006032532.td-b3lyp_6-31g+(d).log.xz

006032532.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032532.td-b3lyp_6-31+g(d).gjf (generated)

006032532.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032532.mol 006032532.PUBCHEM 006032532.mol (via Jmol)
006032678.b3lyp_6-31g(d).inp

006032678.b3lyp_6-31g(d).qchem.inp (generated)

006032678.b3lyp_6-31g(d).gjf (generated)

006032678.b3lyp_6-31g(d).firefly.inp (generated)

006032678.b3lyp_6-31g(d).smash.inp (generated)

006032678.b3lyp_6-31g(d).nwchem.inp (generated) 006032678.b3lyp_6-31g(d).log.xz 006032678.td-b3lyp_6-31g+(d).inp 006032678.td-b3lyp_6-31g+(d).log.xz

006032678.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032678.td-b3lyp_6-31+g(d).gjf (generated)

006032678.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032678.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032678.mol 006032678.PUBCHEM 006032678.mol (via Jmol)
006032704.b3lyp_6-31g(d).inp

006032704.b3lyp_6-31g(d).qchem.inp (generated)

006032704.b3lyp_6-31g(d).gjf (generated)

006032704.b3lyp_6-31g(d).firefly.inp (generated)

006032704.b3lyp_6-31g(d).smash.inp (generated)

006032704.b3lyp_6-31g(d).nwchem.inp (generated) 006032704.b3lyp_6-31g(d).log.xz 006032704.mol 006032704.PUBCHEM 006032704.mol (via Jmol)
006032773.b3lyp_6-31g(d).inp

006032773.b3lyp_6-31g(d).qchem.inp (generated)

006032773.b3lyp_6-31g(d).gjf (generated)

006032773.b3lyp_6-31g(d).firefly.inp (generated)

006032773.b3lyp_6-31g(d).smash.inp (generated)

006032773.b3lyp_6-31g(d).nwchem.inp (generated) 006032773.b3lyp_6-31g(d).log.xz 006032773.td-b3lyp_6-31g+(d).inp 006032773.td-b3lyp_6-31g+(d).log.xz

006032773.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032773.td-b3lyp_6-31+g(d).gjf (generated)

006032773.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032773.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032773.mol 006032773.PUBCHEM 006032773.mol (via Jmol)
006032868.b3lyp_6-31g(d).inp

006032868.b3lyp_6-31g(d).qchem.inp (generated)

006032868.b3lyp_6-31g(d).gjf (generated)

006032868.b3lyp_6-31g(d).firefly.inp (generated)

006032868.b3lyp_6-31g(d).smash.inp (generated)

006032868.b3lyp_6-31g(d).nwchem.inp (generated) 006032868.b3lyp_6-31g(d).log.xz 006032868.td-b3lyp_6-31g+(d).inp 006032868.td-b3lyp_6-31g+(d).log.xz

006032868.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032868.td-b3lyp_6-31+g(d).gjf (generated)

006032868.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032868.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032868.mol 006032868.PUBCHEM 006032868.mol (via Jmol)
006032888.b3lyp_6-31g(d).inp

006032888.b3lyp_6-31g(d).qchem.inp (generated)

006032888.b3lyp_6-31g(d).gjf (generated)

006032888.b3lyp_6-31g(d).firefly.inp (generated)

006032888.b3lyp_6-31g(d).smash.inp (generated)

006032888.b3lyp_6-31g(d).nwchem.inp (generated) 006032888.b3lyp_6-31g(d).log.xz 006032888.td-b3lyp_6-31g+(d).inp 006032888.td-b3lyp_6-31g+(d).log.xz

006032888.td-b3lyp_6-31+g(d).qchem.inp (generated)

006032888.td-b3lyp_6-31+g(d).gjf (generated)

006032888.td-b3lyp_6-31+g(d).firefly.inp (generated)

006032888.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006032888.mol 006032888.PUBCHEM 006032888.mol (via Jmol)
006033060.b3lyp_6-31g(d).inp

006033060.b3lyp_6-31g(d).qchem.inp (generated)

006033060.b3lyp_6-31g(d).gjf (generated)

006033060.b3lyp_6-31g(d).firefly.inp (generated)

006033060.b3lyp_6-31g(d).smash.inp (generated)

006033060.b3lyp_6-31g(d).nwchem.inp (generated) 006033060.b3lyp_6-31g(d).log.xz 006033060.mol 006033060.PUBCHEM 006033060.mol (via Jmol)
006033083.b3lyp_6-31g(d).inp

006033083.b3lyp_6-31g(d).qchem.inp (generated)

006033083.b3lyp_6-31g(d).gjf (generated)

006033083.b3lyp_6-31g(d).firefly.inp (generated)

006033083.b3lyp_6-31g(d).smash.inp (generated)

006033083.b3lyp_6-31g(d).nwchem.inp (generated) 006033083.b3lyp_6-31g(d).log.xz 006033083.mol 006033083.PUBCHEM 006033083.mol (via Jmol)
006033091.b3lyp_6-31g(d).inp

006033091.b3lyp_6-31g(d).qchem.inp (generated)

006033091.b3lyp_6-31g(d).gjf (generated)

006033091.b3lyp_6-31g(d).firefly.inp (generated)

006033091.b3lyp_6-31g(d).smash.inp (generated)

006033091.b3lyp_6-31g(d).nwchem.inp (generated) 006033091.b3lyp_6-31g(d).log.xz 006033091.td-b3lyp_6-31g+(d).inp 006033091.td-b3lyp_6-31g+(d).log.xz

006033091.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033091.td-b3lyp_6-31+g(d).gjf (generated)

006033091.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033091.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033091.mol 006033091.PUBCHEM 006033091.mol (via Jmol)
006033158.b3lyp_6-31g(d).inp

006033158.b3lyp_6-31g(d).qchem.inp (generated)

006033158.b3lyp_6-31g(d).gjf (generated)

006033158.b3lyp_6-31g(d).firefly.inp (generated)

006033158.b3lyp_6-31g(d).smash.inp (generated)

006033158.b3lyp_6-31g(d).nwchem.inp (generated) 006033158.b3lyp_6-31g(d).log.xz 006033158.td-b3lyp_6-31g+(d).inp 006033158.td-b3lyp_6-31g+(d).log.xz

006033158.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033158.td-b3lyp_6-31+g(d).gjf (generated)

006033158.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033158.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033158.mol 006033158.PUBCHEM 006033158.mol (via Jmol)
006033189.b3lyp_6-31g(d).inp

006033189.b3lyp_6-31g(d).qchem.inp (generated)

006033189.b3lyp_6-31g(d).gjf (generated)

006033189.b3lyp_6-31g(d).firefly.inp (generated)

006033189.b3lyp_6-31g(d).smash.inp (generated)

006033189.b3lyp_6-31g(d).nwchem.inp (generated) 006033189.b3lyp_6-31g(d).log.xz 006033189.td-b3lyp_6-31g+(d).inp 006033189.td-b3lyp_6-31g+(d).log.xz

006033189.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033189.td-b3lyp_6-31+g(d).gjf (generated)

006033189.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033189.mol 006033189.PUBCHEM 006033189.mol (via Jmol)
006033272.b3lyp_6-31g(d).inp

006033272.b3lyp_6-31g(d).qchem.inp (generated)

006033272.b3lyp_6-31g(d).gjf (generated)

006033272.b3lyp_6-31g(d).firefly.inp (generated)

006033272.b3lyp_6-31g(d).smash.inp (generated)

006033272.b3lyp_6-31g(d).nwchem.inp (generated) 006033272.b3lyp_6-31g(d).log.xz 006033272.td-b3lyp_6-31g+(d).inp 006033272.td-b3lyp_6-31g+(d).log.xz

006033272.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033272.td-b3lyp_6-31+g(d).gjf (generated)

006033272.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033272.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033272.mol 006033272.PUBCHEM 006033272.mol (via Jmol)
006033288.b3lyp_6-31g(d).inp

006033288.b3lyp_6-31g(d).qchem.inp (generated)

006033288.b3lyp_6-31g(d).gjf (generated)

006033288.b3lyp_6-31g(d).firefly.inp (generated)

006033288.b3lyp_6-31g(d).smash.inp (generated)

006033288.b3lyp_6-31g(d).nwchem.inp (generated) 006033288.b3lyp_6-31g(d).log.xz 006033288.td-b3lyp_6-31g+(d).inp 006033288.td-b3lyp_6-31g+(d).log.xz

006033288.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033288.td-b3lyp_6-31+g(d).gjf (generated)

006033288.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033288.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033288.mol 006033288.PUBCHEM 006033288.mol (via Jmol)
006033333.b3lyp_6-31g(d).inp

006033333.b3lyp_6-31g(d).qchem.inp (generated)

006033333.b3lyp_6-31g(d).gjf (generated)

006033333.b3lyp_6-31g(d).firefly.inp (generated)

006033333.b3lyp_6-31g(d).smash.inp (generated)

006033333.b3lyp_6-31g(d).nwchem.inp (generated) 006033333.b3lyp_6-31g(d).log.xz 006033333.td-b3lyp_6-31g+(d).inp 006033333.td-b3lyp_6-31g+(d).log.xz

006033333.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033333.td-b3lyp_6-31+g(d).gjf (generated)

006033333.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033333.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033333.mol 006033333.PUBCHEM 006033333.mol (via Jmol)
006033435.b3lyp_6-31g(d).inp

006033435.b3lyp_6-31g(d).qchem.inp (generated)

006033435.b3lyp_6-31g(d).gjf (generated)

006033435.b3lyp_6-31g(d).firefly.inp (generated)

006033435.b3lyp_6-31g(d).smash.inp (generated)

006033435.b3lyp_6-31g(d).nwchem.inp (generated) 006033435.b3lyp_6-31g(d).log.xz 006033435.td-b3lyp_6-31g+(d).inp 006033435.td-b3lyp_6-31g+(d).log.xz

006033435.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033435.td-b3lyp_6-31+g(d).gjf (generated)

006033435.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033435.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033435.mol 006033435.PUBCHEM 006033435.mol (via Jmol)
006033519.b3lyp_6-31g(d).inp

006033519.b3lyp_6-31g(d).qchem.inp (generated)

006033519.b3lyp_6-31g(d).gjf (generated)

006033519.b3lyp_6-31g(d).firefly.inp (generated)

006033519.b3lyp_6-31g(d).smash.inp (generated)

006033519.b3lyp_6-31g(d).nwchem.inp (generated) 006033519.b3lyp_6-31g(d).log.xz 006033519.td-b3lyp_6-31g+(d).inp 006033519.td-b3lyp_6-31g+(d).log.xz

006033519.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033519.td-b3lyp_6-31+g(d).gjf (generated)

006033519.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033519.mol 006033519.PUBCHEM 006033519.mol (via Jmol)
006033520.b3lyp_6-31g(d).inp

006033520.b3lyp_6-31g(d).qchem.inp (generated)

006033520.b3lyp_6-31g(d).gjf (generated)

006033520.b3lyp_6-31g(d).firefly.inp (generated)

006033520.b3lyp_6-31g(d).smash.inp (generated)

006033520.b3lyp_6-31g(d).nwchem.inp (generated) 006033520.b3lyp_6-31g(d).log.xz 006033520.mol 006033520.PUBCHEM 006033520.mol (via Jmol)
006033550.b3lyp_6-31g(d).inp

006033550.b3lyp_6-31g(d).qchem.inp (generated)

006033550.b3lyp_6-31g(d).gjf (generated)

006033550.b3lyp_6-31g(d).firefly.inp (generated)

006033550.b3lyp_6-31g(d).smash.inp (generated)

006033550.b3lyp_6-31g(d).nwchem.inp (generated) 006033550.b3lyp_6-31g(d).log.xz 006033550.mol 006033550.PUBCHEM 006033550.mol (via Jmol)
006033605.b3lyp_6-31g(d).inp

006033605.b3lyp_6-31g(d).qchem.inp (generated)

006033605.b3lyp_6-31g(d).gjf (generated)

006033605.b3lyp_6-31g(d).firefly.inp (generated)

006033605.b3lyp_6-31g(d).smash.inp (generated)

006033605.b3lyp_6-31g(d).nwchem.inp (generated) 006033605.b3lyp_6-31g(d).log.xz 006033605.td-b3lyp_6-31g+(d).inp 006033605.td-b3lyp_6-31g+(d).log.xz

006033605.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033605.td-b3lyp_6-31+g(d).gjf (generated)

006033605.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033605.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033605.mol 006033605.PUBCHEM 006033605.mol (via Jmol)
006033619.b3lyp_6-31g(d).inp

006033619.b3lyp_6-31g(d).qchem.inp (generated)

006033619.b3lyp_6-31g(d).gjf (generated)

006033619.b3lyp_6-31g(d).firefly.inp (generated)

006033619.b3lyp_6-31g(d).smash.inp (generated)

006033619.b3lyp_6-31g(d).nwchem.inp (generated) 006033619.b3lyp_6-31g(d).log.xz 006033619.td-b3lyp_6-31g+(d).inp 006033619.td-b3lyp_6-31g+(d).log.xz

006033619.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033619.td-b3lyp_6-31+g(d).gjf (generated)

006033619.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033619.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033619.mol 006033619.PUBCHEM 006033619.mol (via Jmol)
006033658.b3lyp_6-31g(d).inp

006033658.b3lyp_6-31g(d).qchem.inp (generated)

006033658.b3lyp_6-31g(d).gjf (generated)

006033658.b3lyp_6-31g(d).firefly.inp (generated)

006033658.b3lyp_6-31g(d).smash.inp (generated)

006033658.b3lyp_6-31g(d).nwchem.inp (generated) 006033658.b3lyp_6-31g(d).log.xz 006033658.mol 006033658.PUBCHEM 006033658.mol (via Jmol)
006033719.b3lyp_6-31g(d).inp

006033719.b3lyp_6-31g(d).qchem.inp (generated)

006033719.b3lyp_6-31g(d).gjf (generated)

006033719.b3lyp_6-31g(d).firefly.inp (generated)

006033719.b3lyp_6-31g(d).smash.inp (generated)

006033719.b3lyp_6-31g(d).nwchem.inp (generated) 006033719.b3lyp_6-31g(d).log.xz 006033719.mol 006033719.PUBCHEM 006033719.mol (via Jmol)
006033883.b3lyp_6-31g(d).inp

006033883.b3lyp_6-31g(d).qchem.inp (generated)

006033883.b3lyp_6-31g(d).gjf (generated)

006033883.b3lyp_6-31g(d).firefly.inp (generated)

006033883.b3lyp_6-31g(d).smash.inp (generated)

006033883.b3lyp_6-31g(d).nwchem.inp (generated) 006033883.b3lyp_6-31g(d).log.xz 006033883.mol 006033883.PUBCHEM 006033883.mol (via Jmol)
006033885.b3lyp_6-31g(d).inp

006033885.b3lyp_6-31g(d).qchem.inp (generated)

006033885.b3lyp_6-31g(d).gjf (generated)

006033885.b3lyp_6-31g(d).firefly.inp (generated)

006033885.b3lyp_6-31g(d).smash.inp (generated)

006033885.b3lyp_6-31g(d).nwchem.inp (generated) 006033885.b3lyp_6-31g(d).log.xz 006033885.mol 006033885.PUBCHEM 006033885.mol (via Jmol)
006033932.b3lyp_6-31g(d).inp

006033932.b3lyp_6-31g(d).qchem.inp (generated)

006033932.b3lyp_6-31g(d).gjf (generated)

006033932.b3lyp_6-31g(d).firefly.inp (generated)

006033932.b3lyp_6-31g(d).smash.inp (generated)

006033932.b3lyp_6-31g(d).nwchem.inp (generated) 006033932.b3lyp_6-31g(d).log.xz 006033932.mol 006033932.PUBCHEM 006033932.mol (via Jmol)
006033984.b3lyp_6-31g(d).inp

006033984.b3lyp_6-31g(d).qchem.inp (generated)

006033984.b3lyp_6-31g(d).gjf (generated)

006033984.b3lyp_6-31g(d).firefly.inp (generated)

006033984.b3lyp_6-31g(d).smash.inp (generated)

006033984.b3lyp_6-31g(d).nwchem.inp (generated) 006033984.b3lyp_6-31g(d).log.xz 006033984.td-b3lyp_6-31g+(d).inp 006033984.td-b3lyp_6-31g+(d).log.xz

006033984.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033984.td-b3lyp_6-31+g(d).gjf (generated)

006033984.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033984.mol 006033984.PUBCHEM 006033984.mol (via Jmol)
006033992.b3lyp_6-31g(d).inp

006033992.b3lyp_6-31g(d).qchem.inp (generated)

006033992.b3lyp_6-31g(d).gjf (generated)

006033992.b3lyp_6-31g(d).firefly.inp (generated)

006033992.b3lyp_6-31g(d).smash.inp (generated)

006033992.b3lyp_6-31g(d).nwchem.inp (generated) 006033992.b3lyp_6-31g(d).log.xz 006033992.td-b3lyp_6-31g+(d).inp 006033992.td-b3lyp_6-31g+(d).log.xz

006033992.td-b3lyp_6-31+g(d).qchem.inp (generated)

006033992.td-b3lyp_6-31+g(d).gjf (generated)

006033992.td-b3lyp_6-31+g(d).firefly.inp (generated)

006033992.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006033992.mol 006033992.PUBCHEM 006033992.mol (via Jmol)
006034028.b3lyp_6-31g(d).inp

006034028.b3lyp_6-31g(d).qchem.inp (generated)

006034028.b3lyp_6-31g(d).gjf (generated)

006034028.b3lyp_6-31g(d).firefly.inp (generated)

006034028.b3lyp_6-31g(d).smash.inp (generated)

006034028.b3lyp_6-31g(d).nwchem.inp (generated) 006034028.b3lyp_6-31g(d).log.xz 006034028.td-b3lyp_6-31g+(d).inp 006034028.td-b3lyp_6-31g+(d).log.xz

006034028.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034028.td-b3lyp_6-31+g(d).gjf (generated)

006034028.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034028.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034028.mol 006034028.PUBCHEM 006034028.mol (via Jmol)
006034223.b3lyp_6-31g(d).inp

006034223.b3lyp_6-31g(d).qchem.inp (generated)

006034223.b3lyp_6-31g(d).gjf (generated)

006034223.b3lyp_6-31g(d).firefly.inp (generated)

006034223.b3lyp_6-31g(d).smash.inp (generated)

006034223.b3lyp_6-31g(d).nwchem.inp (generated) 006034223.b3lyp_6-31g(d).log.xz 006034223.td-b3lyp_6-31g+(d).inp 006034223.td-b3lyp_6-31g+(d).log.xz

006034223.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034223.td-b3lyp_6-31+g(d).gjf (generated)

006034223.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034223.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034223.mol 006034223.PUBCHEM 006034223.mol (via Jmol)
006034269.b3lyp_6-31g(d).inp

006034269.b3lyp_6-31g(d).qchem.inp (generated)

006034269.b3lyp_6-31g(d).gjf (generated)

006034269.b3lyp_6-31g(d).firefly.inp (generated)

006034269.b3lyp_6-31g(d).smash.inp (generated)

006034269.b3lyp_6-31g(d).nwchem.inp (generated) 006034269.b3lyp_6-31g(d).log.xz 006034269.td-b3lyp_6-31g+(d).inp 006034269.td-b3lyp_6-31g+(d).log.xz

006034269.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034269.td-b3lyp_6-31+g(d).gjf (generated)

006034269.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034269.mol 006034269.PUBCHEM 006034269.mol (via Jmol)
006034285.b3lyp_6-31g(d).inp

006034285.b3lyp_6-31g(d).qchem.inp (generated)

006034285.b3lyp_6-31g(d).gjf (generated)

006034285.b3lyp_6-31g(d).firefly.inp (generated)

006034285.b3lyp_6-31g(d).smash.inp (generated)

006034285.b3lyp_6-31g(d).nwchem.inp (generated) 006034285.b3lyp_6-31g(d).log.xz 006034285.td-b3lyp_6-31g+(d).inp 006034285.td-b3lyp_6-31g+(d).log.xz

006034285.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034285.td-b3lyp_6-31+g(d).gjf (generated)

006034285.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034285.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034285.mol 006034285.PUBCHEM 006034285.mol (via Jmol)
006034410.b3lyp_6-31g(d).inp

006034410.b3lyp_6-31g(d).qchem.inp (generated)

006034410.b3lyp_6-31g(d).gjf (generated)

006034410.b3lyp_6-31g(d).firefly.inp (generated)

006034410.b3lyp_6-31g(d).smash.inp (generated)

006034410.b3lyp_6-31g(d).nwchem.inp (generated) 006034410.b3lyp_6-31g(d).log.xz 006034410.td-b3lyp_6-31g+(d).inp 006034410.td-b3lyp_6-31g+(d).log.xz

006034410.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034410.td-b3lyp_6-31+g(d).gjf (generated)

006034410.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034410.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034410.mol 006034410.PUBCHEM 006034410.mol (via Jmol)
006034415.b3lyp_6-31g(d).inp

006034415.b3lyp_6-31g(d).qchem.inp (generated)

006034415.b3lyp_6-31g(d).gjf (generated)

006034415.b3lyp_6-31g(d).firefly.inp (generated)

006034415.b3lyp_6-31g(d).smash.inp (generated)

006034415.b3lyp_6-31g(d).nwchem.inp (generated) 006034415.b3lyp_6-31g(d).log.xz 006034415.mol 006034415.PUBCHEM 006034415.mol (via Jmol)
006034613.b3lyp_6-31g(d).inp

006034613.b3lyp_6-31g(d).qchem.inp (generated)

006034613.b3lyp_6-31g(d).gjf (generated)

006034613.b3lyp_6-31g(d).firefly.inp (generated)

006034613.b3lyp_6-31g(d).smash.inp (generated)

006034613.b3lyp_6-31g(d).nwchem.inp (generated) 006034613.b3lyp_6-31g(d).log.xz 006034613.td-b3lyp_6-31g+(d).inp 006034613.td-b3lyp_6-31g+(d).log.xz

006034613.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034613.td-b3lyp_6-31+g(d).gjf (generated)

006034613.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034613.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034613.mol 006034613.PUBCHEM 006034613.mol (via Jmol)
006034634.b3lyp_6-31g(d).inp

006034634.b3lyp_6-31g(d).qchem.inp (generated)

006034634.b3lyp_6-31g(d).gjf (generated)

006034634.b3lyp_6-31g(d).firefly.inp (generated)

006034634.b3lyp_6-31g(d).smash.inp (generated)

006034634.b3lyp_6-31g(d).nwchem.inp (generated) 006034634.b3lyp_6-31g(d).log.xz 006034634.td-b3lyp_6-31g+(d).inp 006034634.td-b3lyp_6-31g+(d).log.xz

006034634.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034634.td-b3lyp_6-31+g(d).gjf (generated)

006034634.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034634.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034634.mol 006034634.PUBCHEM 006034634.mol (via Jmol)
006034727.b3lyp_6-31g(d).inp

006034727.b3lyp_6-31g(d).qchem.inp (generated)

006034727.b3lyp_6-31g(d).gjf (generated)

006034727.b3lyp_6-31g(d).firefly.inp (generated)

006034727.b3lyp_6-31g(d).smash.inp (generated)

006034727.b3lyp_6-31g(d).nwchem.inp (generated) 006034727.b3lyp_6-31g(d).log.xz 006034727.td-b3lyp_6-31g+(d).inp 006034727.td-b3lyp_6-31g+(d).log.xz

006034727.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034727.td-b3lyp_6-31+g(d).gjf (generated)

006034727.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034727.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034727.mol 006034727.PUBCHEM 006034727.mol (via Jmol)
006034776.b3lyp_6-31g(d).inp

006034776.b3lyp_6-31g(d).qchem.inp (generated)

006034776.b3lyp_6-31g(d).gjf (generated)

006034776.b3lyp_6-31g(d).firefly.inp (generated)

006034776.b3lyp_6-31g(d).smash.inp (generated)

006034776.b3lyp_6-31g(d).nwchem.inp (generated) 006034776.b3lyp_6-31g(d).log.xz 006034776.td-b3lyp_6-31g+(d).inp 006034776.td-b3lyp_6-31g+(d).log.xz

006034776.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034776.td-b3lyp_6-31+g(d).gjf (generated)

006034776.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034776.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034776.mol 006034776.PUBCHEM 006034776.mol (via Jmol)
006034821.b3lyp_6-31g(d).inp

006034821.b3lyp_6-31g(d).qchem.inp (generated)

006034821.b3lyp_6-31g(d).gjf (generated)

006034821.b3lyp_6-31g(d).firefly.inp (generated)

006034821.b3lyp_6-31g(d).smash.inp (generated)

006034821.b3lyp_6-31g(d).nwchem.inp (generated) 006034821.b3lyp_6-31g(d).log.xz 006034821.td-b3lyp_6-31g+(d).inp 006034821.td-b3lyp_6-31g+(d).log.xz

006034821.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034821.td-b3lyp_6-31+g(d).gjf (generated)

006034821.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034821.mol 006034821.PUBCHEM 006034821.mol (via Jmol)
006034831.b3lyp_6-31g(d).inp

006034831.b3lyp_6-31g(d).qchem.inp (generated)

006034831.b3lyp_6-31g(d).gjf (generated)

006034831.b3lyp_6-31g(d).firefly.inp (generated)

006034831.b3lyp_6-31g(d).smash.inp (generated)

006034831.b3lyp_6-31g(d).nwchem.inp (generated) 006034831.b3lyp_6-31g(d).log.xz 006034831.td-b3lyp_6-31g+(d).inp 006034831.td-b3lyp_6-31g+(d).log.xz

006034831.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034831.td-b3lyp_6-31+g(d).gjf (generated)

006034831.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034831.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034831.mol 006034831.PUBCHEM 006034831.mol (via Jmol)
006034878.b3lyp_6-31g(d).inp

006034878.b3lyp_6-31g(d).qchem.inp (generated)

006034878.b3lyp_6-31g(d).gjf (generated)

006034878.b3lyp_6-31g(d).firefly.inp (generated)

006034878.b3lyp_6-31g(d).smash.inp (generated)

006034878.b3lyp_6-31g(d).nwchem.inp (generated) 006034878.b3lyp_6-31g(d).log.xz 006034878.td-b3lyp_6-31g+(d).inp 006034878.td-b3lyp_6-31g+(d).log.xz

006034878.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034878.td-b3lyp_6-31+g(d).gjf (generated)

006034878.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034878.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034878.mol 006034878.PUBCHEM 006034878.mol (via Jmol)
006034895.b3lyp_6-31g(d).inp

006034895.b3lyp_6-31g(d).qchem.inp (generated)

006034895.b3lyp_6-31g(d).gjf (generated)

006034895.b3lyp_6-31g(d).firefly.inp (generated)

006034895.b3lyp_6-31g(d).smash.inp (generated)

006034895.b3lyp_6-31g(d).nwchem.inp (generated) 006034895.b3lyp_6-31g(d).log.xz 006034895.td-b3lyp_6-31g+(d).inp 006034895.td-b3lyp_6-31g+(d).log.xz

006034895.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034895.td-b3lyp_6-31+g(d).gjf (generated)

006034895.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034895.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034895.mol 006034895.PUBCHEM 006034895.mol (via Jmol)
006034910.b3lyp_6-31g(d).inp

006034910.b3lyp_6-31g(d).qchem.inp (generated)

006034910.b3lyp_6-31g(d).gjf (generated)

006034910.b3lyp_6-31g(d).firefly.inp (generated)

006034910.b3lyp_6-31g(d).smash.inp (generated)

006034910.b3lyp_6-31g(d).nwchem.inp (generated) 006034910.b3lyp_6-31g(d).log.xz 006034910.td-b3lyp_6-31g+(d).inp 006034910.td-b3lyp_6-31g+(d).log.xz

006034910.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034910.td-b3lyp_6-31+g(d).gjf (generated)

006034910.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034910.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034910.mol 006034910.PUBCHEM 006034910.mol (via Jmol)
006034931.b3lyp_6-31g(d).inp

006034931.b3lyp_6-31g(d).qchem.inp (generated)

006034931.b3lyp_6-31g(d).gjf (generated)

006034931.b3lyp_6-31g(d).firefly.inp (generated)

006034931.b3lyp_6-31g(d).smash.inp (generated)

006034931.b3lyp_6-31g(d).nwchem.inp (generated) 006034931.b3lyp_6-31g(d).log.xz 006034931.td-b3lyp_6-31g+(d).inp 006034931.td-b3lyp_6-31g+(d).log.xz

006034931.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034931.td-b3lyp_6-31+g(d).gjf (generated)

006034931.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034931.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034931.mol 006034931.PUBCHEM 006034931.mol (via Jmol)
006034946.b3lyp_6-31g(d).inp

006034946.b3lyp_6-31g(d).qchem.inp (generated)

006034946.b3lyp_6-31g(d).gjf (generated)

006034946.b3lyp_6-31g(d).firefly.inp (generated)

006034946.b3lyp_6-31g(d).smash.inp (generated)

006034946.b3lyp_6-31g(d).nwchem.inp (generated) 006034946.b3lyp_6-31g(d).log.xz 006034946.td-b3lyp_6-31g+(d).inp 006034946.td-b3lyp_6-31g+(d).log.xz

006034946.td-b3lyp_6-31+g(d).qchem.inp (generated)

006034946.td-b3lyp_6-31+g(d).gjf (generated)

006034946.td-b3lyp_6-31+g(d).firefly.inp (generated)

006034946.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006034946.mol 006034946.PUBCHEM 006034946.mol (via Jmol)
006035029.b3lyp_6-31g(d).inp

006035029.b3lyp_6-31g(d).qchem.inp (generated)

006035029.b3lyp_6-31g(d).gjf (generated)

006035029.b3lyp_6-31g(d).firefly.inp (generated)

006035029.b3lyp_6-31g(d).smash.inp (generated)

006035029.b3lyp_6-31g(d).nwchem.inp (generated) 006035029.b3lyp_6-31g(d).log.xz 006035029.td-b3lyp_6-31g+(d).inp 006035029.td-b3lyp_6-31g+(d).log.xz

006035029.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035029.td-b3lyp_6-31+g(d).gjf (generated)

006035029.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035029.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035029.mol 006035029.PUBCHEM 006035029.mol (via Jmol)
006035055.b3lyp_6-31g(d).inp

006035055.b3lyp_6-31g(d).qchem.inp (generated)

006035055.b3lyp_6-31g(d).gjf (generated)

006035055.b3lyp_6-31g(d).firefly.inp (generated)

006035055.b3lyp_6-31g(d).smash.inp (generated)

006035055.b3lyp_6-31g(d).nwchem.inp (generated) 006035055.b3lyp_6-31g(d).log.xz 006035055.td-b3lyp_6-31g+(d).inp 006035055.td-b3lyp_6-31g+(d).log.xz

006035055.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035055.td-b3lyp_6-31+g(d).gjf (generated)

006035055.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035055.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035055.mol 006035055.PUBCHEM 006035055.mol (via Jmol)
006035092.b3lyp_6-31g(d).inp

006035092.b3lyp_6-31g(d).qchem.inp (generated)

006035092.b3lyp_6-31g(d).gjf (generated)

006035092.b3lyp_6-31g(d).firefly.inp (generated)

006035092.b3lyp_6-31g(d).smash.inp (generated)

006035092.b3lyp_6-31g(d).nwchem.inp (generated) 006035092.b3lyp_6-31g(d).log.xz 006035092.td-b3lyp_6-31g+(d).inp 006035092.td-b3lyp_6-31g+(d).log.xz

006035092.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035092.td-b3lyp_6-31+g(d).gjf (generated)

006035092.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035092.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035092.mol 006035092.PUBCHEM 006035092.mol (via Jmol)
006035130.b3lyp_6-31g(d).inp

006035130.b3lyp_6-31g(d).qchem.inp (generated)

006035130.b3lyp_6-31g(d).gjf (generated)

006035130.b3lyp_6-31g(d).firefly.inp (generated)

006035130.b3lyp_6-31g(d).smash.inp (generated)

006035130.b3lyp_6-31g(d).nwchem.inp (generated) 006035130.b3lyp_6-31g(d).log.xz 006035130.mol 006035130.PUBCHEM 006035130.mol (via Jmol)
006035314.b3lyp_6-31g(d).inp

006035314.b3lyp_6-31g(d).qchem.inp (generated)

006035314.b3lyp_6-31g(d).gjf (generated)

006035314.b3lyp_6-31g(d).firefly.inp (generated)

006035314.b3lyp_6-31g(d).smash.inp (generated)

006035314.b3lyp_6-31g(d).nwchem.inp (generated) 006035314.b3lyp_6-31g(d).log.xz 006035314.td-b3lyp_6-31g+(d).inp 006035314.td-b3lyp_6-31g+(d).log.xz

006035314.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035314.td-b3lyp_6-31+g(d).gjf (generated)

006035314.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035314.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035314.mol 006035314.PUBCHEM 006035314.mol (via Jmol)
006035343.b3lyp_6-31g(d).inp

006035343.b3lyp_6-31g(d).qchem.inp (generated)

006035343.b3lyp_6-31g(d).gjf (generated)

006035343.b3lyp_6-31g(d).firefly.inp (generated)

006035343.b3lyp_6-31g(d).smash.inp (generated)

006035343.b3lyp_6-31g(d).nwchem.inp (generated) 006035343.b3lyp_6-31g(d).log.xz 006035343.td-b3lyp_6-31g+(d).inp 006035343.td-b3lyp_6-31g+(d).log.xz

006035343.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035343.td-b3lyp_6-31+g(d).gjf (generated)

006035343.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035343.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035343.mol 006035343.PUBCHEM 006035343.mol (via Jmol)
006035380.b3lyp_6-31g(d).inp

006035380.b3lyp_6-31g(d).qchem.inp (generated)

006035380.b3lyp_6-31g(d).gjf (generated)

006035380.b3lyp_6-31g(d).firefly.inp (generated)

006035380.b3lyp_6-31g(d).smash.inp (generated)

006035380.b3lyp_6-31g(d).nwchem.inp (generated) 006035380.b3lyp_6-31g(d).log.xz 006035380.mol 006035380.PUBCHEM 006035380.mol (via Jmol)
006035497.b3lyp_6-31g(d).inp

006035497.b3lyp_6-31g(d).qchem.inp (generated)

006035497.b3lyp_6-31g(d).gjf (generated)

006035497.b3lyp_6-31g(d).firefly.inp (generated)

006035497.b3lyp_6-31g(d).smash.inp (generated)

006035497.b3lyp_6-31g(d).nwchem.inp (generated) 006035497.b3lyp_6-31g(d).log.xz 006035497.mol 006035497.PUBCHEM 006035497.mol (via Jmol)
006035502.b3lyp_6-31g(d).inp

006035502.b3lyp_6-31g(d).qchem.inp (generated)

006035502.b3lyp_6-31g(d).gjf (generated)

006035502.b3lyp_6-31g(d).firefly.inp (generated)

006035502.b3lyp_6-31g(d).smash.inp (generated)

006035502.b3lyp_6-31g(d).nwchem.inp (generated) 006035502.b3lyp_6-31g(d).log.xz 006035502.mol 006035502.PUBCHEM 006035502.mol (via Jmol)
006035595.b3lyp_6-31g(d).inp

006035595.b3lyp_6-31g(d).qchem.inp (generated)

006035595.b3lyp_6-31g(d).gjf (generated)

006035595.b3lyp_6-31g(d).firefly.inp (generated)

006035595.b3lyp_6-31g(d).smash.inp (generated)

006035595.b3lyp_6-31g(d).nwchem.inp (generated) 006035595.b3lyp_6-31g(d).log.xz 006035595.td-b3lyp_6-31g+(d).inp 006035595.td-b3lyp_6-31g+(d).log.xz

006035595.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035595.td-b3lyp_6-31+g(d).gjf (generated)

006035595.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035595.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035595.mol 006035595.PUBCHEM 006035595.mol (via Jmol)
006035677.b3lyp_6-31g(d).inp

006035677.b3lyp_6-31g(d).qchem.inp (generated)

006035677.b3lyp_6-31g(d).gjf (generated)

006035677.b3lyp_6-31g(d).firefly.inp (generated)

006035677.b3lyp_6-31g(d).smash.inp (generated)

006035677.b3lyp_6-31g(d).nwchem.inp (generated) 006035677.b3lyp_6-31g(d).log.xz 006035677.td-b3lyp_6-31g+(d).inp 006035677.td-b3lyp_6-31g+(d).log.xz

006035677.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035677.td-b3lyp_6-31+g(d).gjf (generated)

006035677.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035677.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035677.mol 006035677.PUBCHEM 006035677.mol (via Jmol)
006035693.b3lyp_6-31g(d).inp

006035693.b3lyp_6-31g(d).qchem.inp (generated)

006035693.b3lyp_6-31g(d).gjf (generated)

006035693.b3lyp_6-31g(d).firefly.inp (generated)

006035693.b3lyp_6-31g(d).smash.inp (generated)

006035693.b3lyp_6-31g(d).nwchem.inp (generated) 006035693.b3lyp_6-31g(d).log.xz 006035693.mol 006035693.PUBCHEM 006035693.mol (via Jmol)
006035829.b3lyp_6-31g(d).inp

006035829.b3lyp_6-31g(d).qchem.inp (generated)

006035829.b3lyp_6-31g(d).gjf (generated)

006035829.b3lyp_6-31g(d).firefly.inp (generated)

006035829.b3lyp_6-31g(d).smash.inp (generated)

006035829.b3lyp_6-31g(d).nwchem.inp (generated) 006035829.b3lyp_6-31g(d).log.xz 006035829.td-b3lyp_6-31g+(d).inp 006035829.td-b3lyp_6-31g+(d).log.xz

006035829.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035829.td-b3lyp_6-31+g(d).gjf (generated)

006035829.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035829.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035829.mol 006035829.PUBCHEM 006035829.mol (via Jmol)
006035881.b3lyp_6-31g(d).inp

006035881.b3lyp_6-31g(d).qchem.inp (generated)

006035881.b3lyp_6-31g(d).gjf (generated)

006035881.b3lyp_6-31g(d).firefly.inp (generated)

006035881.b3lyp_6-31g(d).smash.inp (generated)

006035881.b3lyp_6-31g(d).nwchem.inp (generated) 006035881.b3lyp_6-31g(d).log.xz 006035881.td-b3lyp_6-31g+(d).inp 006035881.td-b3lyp_6-31g+(d).log.xz

006035881.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035881.td-b3lyp_6-31+g(d).gjf (generated)

006035881.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035881.mol 006035881.PUBCHEM 006035881.mol (via Jmol)
006035929.b3lyp_6-31g(d).inp

006035929.b3lyp_6-31g(d).qchem.inp (generated)

006035929.b3lyp_6-31g(d).gjf (generated)

006035929.b3lyp_6-31g(d).firefly.inp (generated)

006035929.b3lyp_6-31g(d).smash.inp (generated)

006035929.b3lyp_6-31g(d).nwchem.inp (generated) 006035929.b3lyp_6-31g(d).log.xz 006035929.td-b3lyp_6-31g+(d).inp 006035929.td-b3lyp_6-31g+(d).log.xz

006035929.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035929.td-b3lyp_6-31+g(d).gjf (generated)

006035929.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035929.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035929.mol 006035929.PUBCHEM 006035929.mol (via Jmol)
006035979.b3lyp_6-31g(d).inp

006035979.b3lyp_6-31g(d).qchem.inp (generated)

006035979.b3lyp_6-31g(d).gjf (generated)

006035979.b3lyp_6-31g(d).firefly.inp (generated)

006035979.b3lyp_6-31g(d).smash.inp (generated)

006035979.b3lyp_6-31g(d).nwchem.inp (generated) 006035979.b3lyp_6-31g(d).log.xz 006035979.td-b3lyp_6-31g+(d).inp 006035979.td-b3lyp_6-31g+(d).log.xz

006035979.td-b3lyp_6-31+g(d).qchem.inp (generated)

006035979.td-b3lyp_6-31+g(d).gjf (generated)

006035979.td-b3lyp_6-31+g(d).firefly.inp (generated)

006035979.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006035979.mol 006035979.PUBCHEM 006035979.mol (via Jmol)
006036125.b3lyp_6-31g(d).inp

006036125.b3lyp_6-31g(d).qchem.inp (generated)

006036125.b3lyp_6-31g(d).gjf (generated)

006036125.b3lyp_6-31g(d).firefly.inp (generated)

006036125.b3lyp_6-31g(d).smash.inp (generated)

006036125.b3lyp_6-31g(d).nwchem.inp (generated) 006036125.b3lyp_6-31g(d).log.xz 006036125.td-b3lyp_6-31g+(d).inp 006036125.td-b3lyp_6-31g+(d).log.xz

006036125.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036125.td-b3lyp_6-31+g(d).gjf (generated)

006036125.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036125.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036125.mol 006036125.PUBCHEM 006036125.mol (via Jmol)
006036148.b3lyp_6-31g(d).inp

006036148.b3lyp_6-31g(d).qchem.inp (generated)

006036148.b3lyp_6-31g(d).gjf (generated)

006036148.b3lyp_6-31g(d).firefly.inp (generated)

006036148.b3lyp_6-31g(d).smash.inp (generated)

006036148.b3lyp_6-31g(d).nwchem.inp (generated) 006036148.b3lyp_6-31g(d).log.xz 006036148.td-b3lyp_6-31g+(d).inp 006036148.td-b3lyp_6-31g+(d).log.xz

006036148.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036148.td-b3lyp_6-31+g(d).gjf (generated)

006036148.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036148.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036148.mol 006036148.PUBCHEM 006036148.mol (via Jmol)
006036248.b3lyp_6-31g(d).inp

006036248.b3lyp_6-31g(d).qchem.inp (generated)

006036248.b3lyp_6-31g(d).gjf (generated)

006036248.b3lyp_6-31g(d).firefly.inp (generated)

006036248.b3lyp_6-31g(d).smash.inp (generated)

006036248.b3lyp_6-31g(d).nwchem.inp (generated) 006036248.b3lyp_6-31g(d).log.xz 006036248.td-b3lyp_6-31g+(d).inp 006036248.td-b3lyp_6-31g+(d).log.xz

006036248.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036248.td-b3lyp_6-31+g(d).gjf (generated)

006036248.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036248.mol 006036248.PUBCHEM 006036248.mol (via Jmol)
006036467.b3lyp_6-31g(d).inp

006036467.b3lyp_6-31g(d).qchem.inp (generated)

006036467.b3lyp_6-31g(d).gjf (generated)

006036467.b3lyp_6-31g(d).firefly.inp (generated)

006036467.b3lyp_6-31g(d).smash.inp (generated)

006036467.b3lyp_6-31g(d).nwchem.inp (generated) 006036467.b3lyp_6-31g(d).log.xz 006036467.td-b3lyp_6-31g+(d).inp 006036467.td-b3lyp_6-31g+(d).log.xz

006036467.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036467.td-b3lyp_6-31+g(d).gjf (generated)

006036467.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036467.mol 006036467.PUBCHEM 006036467.mol (via Jmol)
006036517.b3lyp_6-31g(d).inp

006036517.b3lyp_6-31g(d).qchem.inp (generated)

006036517.b3lyp_6-31g(d).gjf (generated)

006036517.b3lyp_6-31g(d).firefly.inp (generated)

006036517.b3lyp_6-31g(d).smash.inp (generated)

006036517.b3lyp_6-31g(d).nwchem.inp (generated) 006036517.b3lyp_6-31g(d).log.xz 006036517.td-b3lyp_6-31g+(d).inp 006036517.td-b3lyp_6-31g+(d).log.xz

006036517.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036517.td-b3lyp_6-31+g(d).gjf (generated)

006036517.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036517.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036517.mol 006036517.PUBCHEM 006036517.mol (via Jmol)
006036550.b3lyp_6-31g(d).inp

006036550.b3lyp_6-31g(d).qchem.inp (generated)

006036550.b3lyp_6-31g(d).gjf (generated)

006036550.b3lyp_6-31g(d).firefly.inp (generated)

006036550.b3lyp_6-31g(d).smash.inp (generated)

006036550.b3lyp_6-31g(d).nwchem.inp (generated) 006036550.b3lyp_6-31g(d).log.xz 006036550.td-b3lyp_6-31g+(d).inp 006036550.td-b3lyp_6-31g+(d).log.xz

006036550.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036550.td-b3lyp_6-31+g(d).gjf (generated)

006036550.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036550.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036550.mol 006036550.PUBCHEM 006036550.mol (via Jmol)
006036615.b3lyp_6-31g(d).inp

006036615.b3lyp_6-31g(d).qchem.inp (generated)

006036615.b3lyp_6-31g(d).gjf (generated)

006036615.b3lyp_6-31g(d).firefly.inp (generated)

006036615.b3lyp_6-31g(d).smash.inp (generated)

006036615.b3lyp_6-31g(d).nwchem.inp (generated) 006036615.b3lyp_6-31g(d).log.xz 006036615.td-b3lyp_6-31g+(d).inp 006036615.td-b3lyp_6-31g+(d).log.xz

006036615.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036615.td-b3lyp_6-31+g(d).gjf (generated)

006036615.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036615.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036615.mol 006036615.PUBCHEM 006036615.mol (via Jmol)
006036871.b3lyp_6-31g(d).inp

006036871.b3lyp_6-31g(d).qchem.inp (generated)

006036871.b3lyp_6-31g(d).gjf (generated)

006036871.b3lyp_6-31g(d).firefly.inp (generated)

006036871.b3lyp_6-31g(d).smash.inp (generated)

006036871.b3lyp_6-31g(d).nwchem.inp (generated) 006036871.b3lyp_6-31g(d).log.xz 006036871.td-b3lyp_6-31g+(d).inp 006036871.td-b3lyp_6-31g+(d).log.xz

006036871.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036871.td-b3lyp_6-31+g(d).gjf (generated)

006036871.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036871.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036871.mol 006036871.PUBCHEM 006036871.mol (via Jmol)
006036901.b3lyp_6-31g(d).inp

006036901.b3lyp_6-31g(d).qchem.inp (generated)

006036901.b3lyp_6-31g(d).gjf (generated)

006036901.b3lyp_6-31g(d).firefly.inp (generated)

006036901.b3lyp_6-31g(d).smash.inp (generated)

006036901.b3lyp_6-31g(d).nwchem.inp (generated) 006036901.b3lyp_6-31g(d).log.xz 006036901.td-b3lyp_6-31g+(d).inp 006036901.td-b3lyp_6-31g+(d).log.xz

006036901.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036901.td-b3lyp_6-31+g(d).gjf (generated)

006036901.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036901.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036901.mol 006036901.PUBCHEM 006036901.mol (via Jmol)
006036934.b3lyp_6-31g(d).inp

006036934.b3lyp_6-31g(d).qchem.inp (generated)

006036934.b3lyp_6-31g(d).gjf (generated)

006036934.b3lyp_6-31g(d).firefly.inp (generated)

006036934.b3lyp_6-31g(d).smash.inp (generated)

006036934.b3lyp_6-31g(d).nwchem.inp (generated) 006036934.b3lyp_6-31g(d).log.xz 006036934.td-b3lyp_6-31g+(d).inp 006036934.td-b3lyp_6-31g+(d).log.xz

006036934.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036934.td-b3lyp_6-31+g(d).gjf (generated)

006036934.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036934.mol 006036934.PUBCHEM 006036934.mol (via Jmol)
006036983.b3lyp_6-31g(d).inp

006036983.b3lyp_6-31g(d).qchem.inp (generated)

006036983.b3lyp_6-31g(d).gjf (generated)

006036983.b3lyp_6-31g(d).firefly.inp (generated)

006036983.b3lyp_6-31g(d).smash.inp (generated)

006036983.b3lyp_6-31g(d).nwchem.inp (generated) 006036983.b3lyp_6-31g(d).log.xz 006036983.td-b3lyp_6-31g+(d).inp 006036983.td-b3lyp_6-31g+(d).log.xz

006036983.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036983.td-b3lyp_6-31+g(d).gjf (generated)

006036983.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036983.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036983.mol 006036983.PUBCHEM 006036983.mol (via Jmol)
006036986.b3lyp_6-31g(d).inp

006036986.b3lyp_6-31g(d).qchem.inp (generated)

006036986.b3lyp_6-31g(d).gjf (generated)

006036986.b3lyp_6-31g(d).firefly.inp (generated)

006036986.b3lyp_6-31g(d).smash.inp (generated)

006036986.b3lyp_6-31g(d).nwchem.inp (generated) 006036986.b3lyp_6-31g(d).log.xz 006036986.td-b3lyp_6-31g+(d).inp 006036986.td-b3lyp_6-31g+(d).log.xz

006036986.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036986.td-b3lyp_6-31+g(d).gjf (generated)

006036986.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036986.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036986.mol 006036986.PUBCHEM 006036986.mol (via Jmol)
006036991.b3lyp_6-31g(d).inp

006036991.b3lyp_6-31g(d).qchem.inp (generated)

006036991.b3lyp_6-31g(d).gjf (generated)

006036991.b3lyp_6-31g(d).firefly.inp (generated)

006036991.b3lyp_6-31g(d).smash.inp (generated)

006036991.b3lyp_6-31g(d).nwchem.inp (generated) 006036991.b3lyp_6-31g(d).log.xz 006036991.td-b3lyp_6-31g+(d).inp 006036991.td-b3lyp_6-31g+(d).log.xz

006036991.td-b3lyp_6-31+g(d).qchem.inp (generated)

006036991.td-b3lyp_6-31+g(d).gjf (generated)

006036991.td-b3lyp_6-31+g(d).firefly.inp (generated)

006036991.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006036991.mol 006036991.PUBCHEM 006036991.mol (via Jmol)
006037082.b3lyp_6-31g(d).inp

006037082.b3lyp_6-31g(d).qchem.inp (generated)

006037082.b3lyp_6-31g(d).gjf (generated)

006037082.b3lyp_6-31g(d).firefly.inp (generated)

006037082.b3lyp_6-31g(d).smash.inp (generated)

006037082.b3lyp_6-31g(d).nwchem.inp (generated) 006037082.b3lyp_6-31g(d).log.xz 006037082.td-b3lyp_6-31g+(d).inp 006037082.td-b3lyp_6-31g+(d).log.xz

006037082.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037082.td-b3lyp_6-31+g(d).gjf (generated)

006037082.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037082.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037082.mol 006037082.PUBCHEM 006037082.mol (via Jmol)
006037153.b3lyp_6-31g(d).inp

006037153.b3lyp_6-31g(d).qchem.inp (generated)

006037153.b3lyp_6-31g(d).gjf (generated)

006037153.b3lyp_6-31g(d).firefly.inp (generated)

006037153.b3lyp_6-31g(d).smash.inp (generated)

006037153.b3lyp_6-31g(d).nwchem.inp (generated) 006037153.b3lyp_6-31g(d).log.xz 006037153.td-b3lyp_6-31g+(d).inp 006037153.td-b3lyp_6-31g+(d).log.xz

006037153.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037153.td-b3lyp_6-31+g(d).gjf (generated)

006037153.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037153.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037153.mol 006037153.PUBCHEM 006037153.mol (via Jmol)
006037335.b3lyp_6-31g(d).inp

006037335.b3lyp_6-31g(d).qchem.inp (generated)

006037335.b3lyp_6-31g(d).gjf (generated)

006037335.b3lyp_6-31g(d).firefly.inp (generated)

006037335.b3lyp_6-31g(d).smash.inp (generated)

006037335.b3lyp_6-31g(d).nwchem.inp (generated) 006037335.b3lyp_6-31g(d).log.xz 006037335.td-b3lyp_6-31g+(d).inp 006037335.td-b3lyp_6-31g+(d).log.xz

006037335.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037335.td-b3lyp_6-31+g(d).gjf (generated)

006037335.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037335.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037335.mol 006037335.PUBCHEM 006037335.mol (via Jmol)
006037357.b3lyp_6-31g(d).inp

006037357.b3lyp_6-31g(d).qchem.inp (generated)

006037357.b3lyp_6-31g(d).gjf (generated)

006037357.b3lyp_6-31g(d).firefly.inp (generated)

006037357.b3lyp_6-31g(d).smash.inp (generated)

006037357.b3lyp_6-31g(d).nwchem.inp (generated) 006037357.b3lyp_6-31g(d).log.xz 006037357.td-b3lyp_6-31g+(d).inp 006037357.td-b3lyp_6-31g+(d).log.xz

006037357.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037357.td-b3lyp_6-31+g(d).gjf (generated)

006037357.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037357.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037357.mol 006037357.PUBCHEM 006037357.mol (via Jmol)
006037358.b3lyp_6-31g(d).inp

006037358.b3lyp_6-31g(d).qchem.inp (generated)

006037358.b3lyp_6-31g(d).gjf (generated)

006037358.b3lyp_6-31g(d).firefly.inp (generated)

006037358.b3lyp_6-31g(d).smash.inp (generated)

006037358.b3lyp_6-31g(d).nwchem.inp (generated) 006037358.b3lyp_6-31g(d).log.xz 006037358.td-b3lyp_6-31g+(d).inp 006037358.td-b3lyp_6-31g+(d).log.xz

006037358.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037358.td-b3lyp_6-31+g(d).gjf (generated)

006037358.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037358.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037358.mol 006037358.PUBCHEM 006037358.mol (via Jmol)
006037415.b3lyp_6-31g(d).inp

006037415.b3lyp_6-31g(d).qchem.inp (generated)

006037415.b3lyp_6-31g(d).gjf (generated)

006037415.b3lyp_6-31g(d).firefly.inp (generated)

006037415.b3lyp_6-31g(d).smash.inp (generated)

006037415.b3lyp_6-31g(d).nwchem.inp (generated) 006037415.b3lyp_6-31g(d).log.xz 006037415.mol 006037415.PUBCHEM 006037415.mol (via Jmol)
006037442.b3lyp_6-31g(d).inp

006037442.b3lyp_6-31g(d).qchem.inp (generated)

006037442.b3lyp_6-31g(d).gjf (generated)

006037442.b3lyp_6-31g(d).firefly.inp (generated)

006037442.b3lyp_6-31g(d).smash.inp (generated)

006037442.b3lyp_6-31g(d).nwchem.inp (generated) 006037442.b3lyp_6-31g(d).log.xz 006037442.td-b3lyp_6-31g+(d).inp 006037442.td-b3lyp_6-31g+(d).log.xz

006037442.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037442.td-b3lyp_6-31+g(d).gjf (generated)

006037442.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037442.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037442.mol 006037442.PUBCHEM 006037442.mol (via Jmol)
006037461.b3lyp_6-31g(d).inp

006037461.b3lyp_6-31g(d).qchem.inp (generated)

006037461.b3lyp_6-31g(d).gjf (generated)

006037461.b3lyp_6-31g(d).firefly.inp (generated)

006037461.b3lyp_6-31g(d).smash.inp (generated)

006037461.b3lyp_6-31g(d).nwchem.inp (generated) 006037461.b3lyp_6-31g(d).log.xz 006037461.td-b3lyp_6-31g+(d).inp 006037461.td-b3lyp_6-31g+(d).log.xz

006037461.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037461.td-b3lyp_6-31+g(d).gjf (generated)

006037461.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037461.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037461.mol 006037461.PUBCHEM 006037461.mol (via Jmol)
006037524.b3lyp_6-31g(d).inp

006037524.b3lyp_6-31g(d).qchem.inp (generated)

006037524.b3lyp_6-31g(d).gjf (generated)

006037524.b3lyp_6-31g(d).firefly.inp (generated)

006037524.b3lyp_6-31g(d).smash.inp (generated)

006037524.b3lyp_6-31g(d).nwchem.inp (generated) 006037524.b3lyp_6-31g(d).log.xz 006037524.td-b3lyp_6-31g+(d).inp 006037524.td-b3lyp_6-31g+(d).log.xz

006037524.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037524.td-b3lyp_6-31+g(d).gjf (generated)

006037524.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037524.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037524.mol 006037524.PUBCHEM 006037524.mol (via Jmol)
006037573.b3lyp_6-31g(d).inp

006037573.b3lyp_6-31g(d).qchem.inp (generated)

006037573.b3lyp_6-31g(d).gjf (generated)

006037573.b3lyp_6-31g(d).firefly.inp (generated)

006037573.b3lyp_6-31g(d).smash.inp (generated)

006037573.b3lyp_6-31g(d).nwchem.inp (generated) 006037573.b3lyp_6-31g(d).log.xz 006037573.td-b3lyp_6-31g+(d).inp 006037573.td-b3lyp_6-31g+(d).log.xz

006037573.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037573.td-b3lyp_6-31+g(d).gjf (generated)

006037573.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037573.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037573.mol 006037573.PUBCHEM 006037573.mol (via Jmol)
006037657.b3lyp_6-31g(d).inp

006037657.b3lyp_6-31g(d).qchem.inp (generated)

006037657.b3lyp_6-31g(d).gjf (generated)

006037657.b3lyp_6-31g(d).firefly.inp (generated)

006037657.b3lyp_6-31g(d).smash.inp (generated)

006037657.b3lyp_6-31g(d).nwchem.inp (generated) 006037657.b3lyp_6-31g(d).log.xz 006037657.td-b3lyp_6-31g+(d).inp 006037657.td-b3lyp_6-31g+(d).log.xz

006037657.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037657.td-b3lyp_6-31+g(d).gjf (generated)

006037657.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037657.mol 006037657.PUBCHEM 006037657.mol (via Jmol)
006037658.b3lyp_6-31g(d).inp

006037658.b3lyp_6-31g(d).qchem.inp (generated)

006037658.b3lyp_6-31g(d).gjf (generated)

006037658.b3lyp_6-31g(d).firefly.inp (generated)

006037658.b3lyp_6-31g(d).smash.inp (generated)

006037658.b3lyp_6-31g(d).nwchem.inp (generated) 006037658.b3lyp_6-31g(d).log.xz 006037658.td-b3lyp_6-31g+(d).inp 006037658.td-b3lyp_6-31g+(d).log.xz

006037658.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037658.td-b3lyp_6-31+g(d).gjf (generated)

006037658.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037658.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037658.mol 006037658.PUBCHEM 006037658.mol (via Jmol)
006037674.b3lyp_6-31g(d).inp

006037674.b3lyp_6-31g(d).qchem.inp (generated)

006037674.b3lyp_6-31g(d).gjf (generated)

006037674.b3lyp_6-31g(d).firefly.inp (generated)

006037674.b3lyp_6-31g(d).smash.inp (generated)

006037674.b3lyp_6-31g(d).nwchem.inp (generated) 006037674.b3lyp_6-31g(d).log.xz 006037674.td-b3lyp_6-31g+(d).inp 006037674.td-b3lyp_6-31g+(d).log.xz

006037674.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037674.td-b3lyp_6-31+g(d).gjf (generated)

006037674.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037674.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037674.mol 006037674.PUBCHEM 006037674.mol (via Jmol)
006037790.b3lyp_6-31g(d).inp

006037790.b3lyp_6-31g(d).qchem.inp (generated)

006037790.b3lyp_6-31g(d).gjf (generated)

006037790.b3lyp_6-31g(d).firefly.inp (generated)

006037790.b3lyp_6-31g(d).smash.inp (generated)

006037790.b3lyp_6-31g(d).nwchem.inp (generated) 006037790.b3lyp_6-31g(d).log.xz 006037790.td-b3lyp_6-31g+(d).inp 006037790.td-b3lyp_6-31g+(d).log.xz

006037790.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037790.td-b3lyp_6-31+g(d).gjf (generated)

006037790.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037790.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037790.mol 006037790.PUBCHEM 006037790.mol (via Jmol)
006037811.b3lyp_6-31g(d).inp

006037811.b3lyp_6-31g(d).qchem.inp (generated)

006037811.b3lyp_6-31g(d).gjf (generated)

006037811.b3lyp_6-31g(d).firefly.inp (generated)

006037811.b3lyp_6-31g(d).smash.inp (generated)

006037811.b3lyp_6-31g(d).nwchem.inp (generated) 006037811.b3lyp_6-31g(d).log.xz 006037811.td-b3lyp_6-31g+(d).inp 006037811.td-b3lyp_6-31g+(d).log.xz

006037811.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037811.td-b3lyp_6-31+g(d).gjf (generated)

006037811.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037811.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037811.mol 006037811.PUBCHEM 006037811.mol (via Jmol)
006037857.b3lyp_6-31g(d).inp

006037857.b3lyp_6-31g(d).qchem.inp (generated)

006037857.b3lyp_6-31g(d).gjf (generated)

006037857.b3lyp_6-31g(d).firefly.inp (generated)

006037857.b3lyp_6-31g(d).smash.inp (generated)

006037857.b3lyp_6-31g(d).nwchem.inp (generated) 006037857.b3lyp_6-31g(d).log.xz 006037857.td-b3lyp_6-31g+(d).inp 006037857.td-b3lyp_6-31g+(d).log.xz

006037857.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037857.td-b3lyp_6-31+g(d).gjf (generated)

006037857.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037857.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037857.mol 006037857.PUBCHEM 006037857.mol (via Jmol)
006037947.b3lyp_6-31g(d).inp

006037947.b3lyp_6-31g(d).qchem.inp (generated)

006037947.b3lyp_6-31g(d).gjf (generated)

006037947.b3lyp_6-31g(d).firefly.inp (generated)

006037947.b3lyp_6-31g(d).smash.inp (generated)

006037947.b3lyp_6-31g(d).nwchem.inp (generated) 006037947.b3lyp_6-31g(d).log.xz 006037947.td-b3lyp_6-31g+(d).inp 006037947.td-b3lyp_6-31g+(d).log.xz

006037947.td-b3lyp_6-31+g(d).qchem.inp (generated)

006037947.td-b3lyp_6-31+g(d).gjf (generated)

006037947.td-b3lyp_6-31+g(d).firefly.inp (generated)

006037947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006037947.mol 006037947.PUBCHEM 006037947.mol (via Jmol)
006038248.b3lyp_6-31g(d).inp

006038248.b3lyp_6-31g(d).qchem.inp (generated)

006038248.b3lyp_6-31g(d).gjf (generated)

006038248.b3lyp_6-31g(d).firefly.inp (generated)

006038248.b3lyp_6-31g(d).smash.inp (generated)

006038248.b3lyp_6-31g(d).nwchem.inp (generated) 006038248.b3lyp_6-31g(d).log.xz 006038248.td-b3lyp_6-31g+(d).inp 006038248.td-b3lyp_6-31g+(d).log.xz

006038248.td-b3lyp_6-31+g(d).qchem.inp (generated)

006038248.td-b3lyp_6-31+g(d).gjf (generated)

006038248.td-b3lyp_6-31+g(d).firefly.inp (generated)

006038248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006038248.mol 006038248.PUBCHEM 006038248.mol (via Jmol)
006038334.b3lyp_6-31g(d).inp

006038334.b3lyp_6-31g(d).qchem.inp (generated)

006038334.b3lyp_6-31g(d).gjf (generated)

006038334.b3lyp_6-31g(d).firefly.inp (generated)

006038334.b3lyp_6-31g(d).smash.inp (generated)

006038334.b3lyp_6-31g(d).nwchem.inp (generated) 006038334.b3lyp_6-31g(d).log.xz 006038334.td-b3lyp_6-31g+(d).inp 006038334.td-b3lyp_6-31g+(d).log.xz

006038334.td-b3lyp_6-31+g(d).qchem.inp (generated)

006038334.td-b3lyp_6-31+g(d).gjf (generated)

006038334.td-b3lyp_6-31+g(d).firefly.inp (generated)

006038334.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006038334.mol 006038334.PUBCHEM 006038334.mol (via Jmol)
006038575.b3lyp_6-31g(d).inp

006038575.b3lyp_6-31g(d).qchem.inp (generated)

006038575.b3lyp_6-31g(d).gjf (generated)

006038575.b3lyp_6-31g(d).firefly.inp (generated)

006038575.b3lyp_6-31g(d).smash.inp (generated)

006038575.b3lyp_6-31g(d).nwchem.inp (generated) 006038575.b3lyp_6-31g(d).log.xz 006038575.td-b3lyp_6-31g+(d).inp 006038575.td-b3lyp_6-31g+(d).log.xz

006038575.td-b3lyp_6-31+g(d).qchem.inp (generated)

006038575.td-b3lyp_6-31+g(d).gjf (generated)

006038575.td-b3lyp_6-31+g(d).firefly.inp (generated)

006038575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006038575.mol 006038575.PUBCHEM 006038575.mol (via Jmol)
006038614.b3lyp_6-31g(d).inp

006038614.b3lyp_6-31g(d).qchem.inp (generated)

006038614.b3lyp_6-31g(d).gjf (generated)

006038614.b3lyp_6-31g(d).firefly.inp (generated)

006038614.b3lyp_6-31g(d).smash.inp (generated)

006038614.b3lyp_6-31g(d).nwchem.inp (generated) 006038614.b3lyp_6-31g(d).log.xz 006038614.td-b3lyp_6-31g+(d).inp 006038614.td-b3lyp_6-31g+(d).log.xz

006038614.td-b3lyp_6-31+g(d).qchem.inp (generated)

006038614.td-b3lyp_6-31+g(d).gjf (generated)

006038614.td-b3lyp_6-31+g(d).firefly.inp (generated)

006038614.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006038614.mol 006038614.PUBCHEM 006038614.mol (via Jmol)
006038713.b3lyp_6-31g(d).inp

006038713.b3lyp_6-31g(d).qchem.inp (generated)

006038713.b3lyp_6-31g(d).gjf (generated)

006038713.b3lyp_6-31g(d).firefly.inp (generated)

006038713.b3lyp_6-31g(d).smash.inp (generated)

006038713.b3lyp_6-31g(d).nwchem.inp (generated) 006038713.b3lyp_6-31g(d).log.xz 006038713.mol 006038713.PUBCHEM 006038713.mol (via Jmol)
006038820.b3lyp_6-31g(d).inp

006038820.b3lyp_6-31g(d).qchem.inp (generated)

006038820.b3lyp_6-31g(d).gjf (generated)

006038820.b3lyp_6-31g(d).firefly.inp (generated)

006038820.b3lyp_6-31g(d).smash.inp (generated)

006038820.b3lyp_6-31g(d).nwchem.inp (generated) 006038820.b3lyp_6-31g(d).log.xz 006038820.td-b3lyp_6-31g+(d).inp 006038820.td-b3lyp_6-31g+(d).log.xz

006038820.td-b3lyp_6-31+g(d).qchem.inp (generated)

006038820.td-b3lyp_6-31+g(d).gjf (generated)

006038820.td-b3lyp_6-31+g(d).firefly.inp (generated)

006038820.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006038820.mol 006038820.PUBCHEM 006038820.mol (via Jmol)
006038894.b3lyp_6-31g(d).inp

006038894.b3lyp_6-31g(d).qchem.inp (generated)

006038894.b3lyp_6-31g(d).gjf (generated)

006038894.b3lyp_6-31g(d).firefly.inp (generated)

006038894.b3lyp_6-31g(d).smash.inp (generated)

006038894.b3lyp_6-31g(d).nwchem.inp (generated) 006038894.b3lyp_6-31g(d).log.xz 006038894.td-b3lyp_6-31g+(d).inp 006038894.td-b3lyp_6-31g+(d).log.xz

006038894.td-b3lyp_6-31+g(d).qchem.inp (generated)

006038894.td-b3lyp_6-31+g(d).gjf (generated)

006038894.td-b3lyp_6-31+g(d).firefly.inp (generated)

006038894.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006038894.mol 006038894.PUBCHEM 006038894.mol (via Jmol)
006038912.b3lyp_6-31g(d).inp

006038912.b3lyp_6-31g(d).qchem.inp (generated)

006038912.b3lyp_6-31g(d).gjf (generated)

006038912.b3lyp_6-31g(d).firefly.inp (generated)

006038912.b3lyp_6-31g(d).smash.inp (generated)

006038912.b3lyp_6-31g(d).nwchem.inp (generated) 006038912.b3lyp_6-31g(d).log.xz 006038912.td-b3lyp_6-31g+(d).inp 006038912.td-b3lyp_6-31g+(d).log.xz

006038912.td-b3lyp_6-31+g(d).qchem.inp (generated)

006038912.td-b3lyp_6-31+g(d).gjf (generated)

006038912.td-b3lyp_6-31+g(d).firefly.inp (generated)

006038912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006038912.mol 006038912.PUBCHEM 006038912.mol (via Jmol)
006039180.b3lyp_6-31g(d).inp

006039180.b3lyp_6-31g(d).qchem.inp (generated)

006039180.b3lyp_6-31g(d).gjf (generated)

006039180.b3lyp_6-31g(d).firefly.inp (generated)

006039180.b3lyp_6-31g(d).smash.inp (generated)

006039180.b3lyp_6-31g(d).nwchem.inp (generated) 006039180.b3lyp_6-31g(d).log.xz 006039180.td-b3lyp_6-31g+(d).inp 006039180.td-b3lyp_6-31g+(d).log.xz

006039180.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039180.td-b3lyp_6-31+g(d).gjf (generated)

006039180.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039180.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039180.mol 006039180.PUBCHEM 006039180.mol (via Jmol)
006039202.b3lyp_6-31g(d).inp

006039202.b3lyp_6-31g(d).qchem.inp (generated)

006039202.b3lyp_6-31g(d).gjf (generated)

006039202.b3lyp_6-31g(d).firefly.inp (generated)

006039202.b3lyp_6-31g(d).smash.inp (generated)

006039202.b3lyp_6-31g(d).nwchem.inp (generated) 006039202.b3lyp_6-31g(d).log.xz 006039202.td-b3lyp_6-31g+(d).inp 006039202.td-b3lyp_6-31g+(d).log.xz

006039202.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039202.td-b3lyp_6-31+g(d).gjf (generated)

006039202.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039202.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039202.mol 006039202.PUBCHEM 006039202.mol (via Jmol)
006039230.b3lyp_6-31g(d).inp

006039230.b3lyp_6-31g(d).qchem.inp (generated)

006039230.b3lyp_6-31g(d).gjf (generated)

006039230.b3lyp_6-31g(d).firefly.inp (generated)

006039230.b3lyp_6-31g(d).smash.inp (generated)

006039230.b3lyp_6-31g(d).nwchem.inp (generated) 006039230.b3lyp_6-31g(d).log.xz 006039230.td-b3lyp_6-31g+(d).inp 006039230.td-b3lyp_6-31g+(d).log.xz

006039230.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039230.td-b3lyp_6-31+g(d).gjf (generated)

006039230.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039230.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039230.mol 006039230.PUBCHEM 006039230.mol (via Jmol)
006039235.b3lyp_6-31g(d).inp

006039235.b3lyp_6-31g(d).qchem.inp (generated)

006039235.b3lyp_6-31g(d).gjf (generated)

006039235.b3lyp_6-31g(d).firefly.inp (generated)

006039235.b3lyp_6-31g(d).smash.inp (generated)

006039235.b3lyp_6-31g(d).nwchem.inp (generated) 006039235.b3lyp_6-31g(d).log.xz 006039235.td-b3lyp_6-31g+(d).inp 006039235.td-b3lyp_6-31g+(d).log.xz

006039235.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039235.td-b3lyp_6-31+g(d).gjf (generated)

006039235.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039235.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039235.mol 006039235.PUBCHEM 006039235.mol (via Jmol)
006039260.b3lyp_6-31g(d).inp

006039260.b3lyp_6-31g(d).qchem.inp (generated)

006039260.b3lyp_6-31g(d).gjf (generated)

006039260.b3lyp_6-31g(d).firefly.inp (generated)

006039260.b3lyp_6-31g(d).smash.inp (generated)

006039260.b3lyp_6-31g(d).nwchem.inp (generated) 006039260.b3lyp_6-31g(d).log.xz 006039260.td-b3lyp_6-31g+(d).inp 006039260.td-b3lyp_6-31g+(d).log.xz

006039260.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039260.td-b3lyp_6-31+g(d).gjf (generated)

006039260.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039260.mol 006039260.PUBCHEM 006039260.mol (via Jmol)
006039398.b3lyp_6-31g(d).inp

006039398.b3lyp_6-31g(d).qchem.inp (generated)

006039398.b3lyp_6-31g(d).gjf (generated)

006039398.b3lyp_6-31g(d).firefly.inp (generated)

006039398.b3lyp_6-31g(d).smash.inp (generated)

006039398.b3lyp_6-31g(d).nwchem.inp (generated) 006039398.b3lyp_6-31g(d).log.xz 006039398.td-b3lyp_6-31g+(d).inp 006039398.td-b3lyp_6-31g+(d).log.xz

006039398.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039398.td-b3lyp_6-31+g(d).gjf (generated)

006039398.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039398.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039398.mol 006039398.PUBCHEM 006039398.mol (via Jmol)
006039446.b3lyp_6-31g(d).inp

006039446.b3lyp_6-31g(d).qchem.inp (generated)

006039446.b3lyp_6-31g(d).gjf (generated)

006039446.b3lyp_6-31g(d).firefly.inp (generated)

006039446.b3lyp_6-31g(d).smash.inp (generated)

006039446.b3lyp_6-31g(d).nwchem.inp (generated) 006039446.b3lyp_6-31g(d).log.xz 006039446.td-b3lyp_6-31g+(d).inp 006039446.td-b3lyp_6-31g+(d).log.xz

006039446.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039446.td-b3lyp_6-31+g(d).gjf (generated)

006039446.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039446.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039446.mol 006039446.PUBCHEM 006039446.mol (via Jmol)
006039522.b3lyp_6-31g(d).inp

006039522.b3lyp_6-31g(d).qchem.inp (generated)

006039522.b3lyp_6-31g(d).gjf (generated)

006039522.b3lyp_6-31g(d).firefly.inp (generated)

006039522.b3lyp_6-31g(d).smash.inp (generated)

006039522.b3lyp_6-31g(d).nwchem.inp (generated) 006039522.b3lyp_6-31g(d).log.xz 006039522.td-b3lyp_6-31g+(d).inp 006039522.td-b3lyp_6-31g+(d).log.xz

006039522.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039522.td-b3lyp_6-31+g(d).gjf (generated)

006039522.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039522.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039522.mol 006039522.PUBCHEM 006039522.mol (via Jmol)
006039702.b3lyp_6-31g(d).inp

006039702.b3lyp_6-31g(d).qchem.inp (generated)

006039702.b3lyp_6-31g(d).gjf (generated)

006039702.b3lyp_6-31g(d).firefly.inp (generated)

006039702.b3lyp_6-31g(d).smash.inp (generated)

006039702.b3lyp_6-31g(d).nwchem.inp (generated) 006039702.b3lyp_6-31g(d).log.xz 006039702.td-b3lyp_6-31g+(d).inp 006039702.td-b3lyp_6-31g+(d).log.xz

006039702.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039702.td-b3lyp_6-31+g(d).gjf (generated)

006039702.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039702.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039702.mol 006039702.PUBCHEM 006039702.mol (via Jmol)
006039815.b3lyp_6-31g(d).inp

006039815.b3lyp_6-31g(d).qchem.inp (generated)

006039815.b3lyp_6-31g(d).gjf (generated)

006039815.b3lyp_6-31g(d).firefly.inp (generated)

006039815.b3lyp_6-31g(d).smash.inp (generated)

006039815.b3lyp_6-31g(d).nwchem.inp (generated) 006039815.b3lyp_6-31g(d).log.xz 006039815.td-b3lyp_6-31g+(d).inp 006039815.td-b3lyp_6-31g+(d).log.xz

006039815.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039815.td-b3lyp_6-31+g(d).gjf (generated)

006039815.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039815.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039815.mol 006039815.PUBCHEM 006039815.mol (via Jmol)
006039896.b3lyp_6-31g(d).inp

006039896.b3lyp_6-31g(d).qchem.inp (generated)

006039896.b3lyp_6-31g(d).gjf (generated)

006039896.b3lyp_6-31g(d).firefly.inp (generated)

006039896.b3lyp_6-31g(d).smash.inp (generated)

006039896.b3lyp_6-31g(d).nwchem.inp (generated) 006039896.b3lyp_6-31g(d).log.xz 006039896.td-b3lyp_6-31g+(d).inp 006039896.td-b3lyp_6-31g+(d).log.xz

006039896.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039896.td-b3lyp_6-31+g(d).gjf (generated)

006039896.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039896.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039896.mol 006039896.PUBCHEM 006039896.mol (via Jmol)
006039964.b3lyp_6-31g(d).inp

006039964.b3lyp_6-31g(d).qchem.inp (generated)

006039964.b3lyp_6-31g(d).gjf (generated)

006039964.b3lyp_6-31g(d).firefly.inp (generated)

006039964.b3lyp_6-31g(d).smash.inp (generated)

006039964.b3lyp_6-31g(d).nwchem.inp (generated) 006039964.b3lyp_6-31g(d).log.xz 006039964.td-b3lyp_6-31g+(d).inp 006039964.td-b3lyp_6-31g+(d).log.xz

006039964.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039964.td-b3lyp_6-31+g(d).gjf (generated)

006039964.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039964.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039964.mol 006039964.PUBCHEM 006039964.mol (via Jmol)
006039989.b3lyp_6-31g(d).inp

006039989.b3lyp_6-31g(d).qchem.inp (generated)

006039989.b3lyp_6-31g(d).gjf (generated)

006039989.b3lyp_6-31g(d).firefly.inp (generated)

006039989.b3lyp_6-31g(d).smash.inp (generated)

006039989.b3lyp_6-31g(d).nwchem.inp (generated) 006039989.b3lyp_6-31g(d).log.xz 006039989.td-b3lyp_6-31g+(d).inp 006039989.td-b3lyp_6-31g+(d).log.xz

006039989.td-b3lyp_6-31+g(d).qchem.inp (generated)

006039989.td-b3lyp_6-31+g(d).gjf (generated)

006039989.td-b3lyp_6-31+g(d).firefly.inp (generated)

006039989.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006039989.mol 006039989.PUBCHEM 006039989.mol (via Jmol)
006040006.b3lyp_6-31g(d).inp

006040006.b3lyp_6-31g(d).qchem.inp (generated)

006040006.b3lyp_6-31g(d).gjf (generated)

006040006.b3lyp_6-31g(d).firefly.inp (generated)

006040006.b3lyp_6-31g(d).smash.inp (generated)

006040006.b3lyp_6-31g(d).nwchem.inp (generated) 006040006.b3lyp_6-31g(d).log.xz 006040006.mol 006040006.PUBCHEM 006040006.mol (via Jmol)
006040013.b3lyp_6-31g(d).inp

006040013.b3lyp_6-31g(d).qchem.inp (generated)

006040013.b3lyp_6-31g(d).gjf (generated)

006040013.b3lyp_6-31g(d).firefly.inp (generated)

006040013.b3lyp_6-31g(d).smash.inp (generated)

006040013.b3lyp_6-31g(d).nwchem.inp (generated) 006040013.b3lyp_6-31g(d).log.xz 006040013.td-b3lyp_6-31g+(d).inp 006040013.td-b3lyp_6-31g+(d).log.xz

006040013.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040013.td-b3lyp_6-31+g(d).gjf (generated)

006040013.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040013.mol 006040013.PUBCHEM 006040013.mol (via Jmol)
006040239.b3lyp_6-31g(d).inp

006040239.b3lyp_6-31g(d).qchem.inp (generated)

006040239.b3lyp_6-31g(d).gjf (generated)

006040239.b3lyp_6-31g(d).firefly.inp (generated)

006040239.b3lyp_6-31g(d).smash.inp (generated)

006040239.b3lyp_6-31g(d).nwchem.inp (generated) 006040239.b3lyp_6-31g(d).log.xz 006040239.td-b3lyp_6-31g+(d).inp 006040239.td-b3lyp_6-31g+(d).log.xz

006040239.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040239.td-b3lyp_6-31+g(d).gjf (generated)

006040239.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040239.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040239.mol 006040239.PUBCHEM 006040239.mol (via Jmol)
006040355.b3lyp_6-31g(d).inp

006040355.b3lyp_6-31g(d).qchem.inp (generated)

006040355.b3lyp_6-31g(d).gjf (generated)

006040355.b3lyp_6-31g(d).firefly.inp (generated)

006040355.b3lyp_6-31g(d).smash.inp (generated)

006040355.b3lyp_6-31g(d).nwchem.inp (generated) 006040355.b3lyp_6-31g(d).log.xz 006040355.td-b3lyp_6-31g+(d).inp 006040355.td-b3lyp_6-31g+(d).log.xz

006040355.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040355.td-b3lyp_6-31+g(d).gjf (generated)

006040355.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040355.mol 006040355.PUBCHEM 006040355.mol (via Jmol)
006040503.b3lyp_6-31g(d).inp

006040503.b3lyp_6-31g(d).qchem.inp (generated)

006040503.b3lyp_6-31g(d).gjf (generated)

006040503.b3lyp_6-31g(d).firefly.inp (generated)

006040503.b3lyp_6-31g(d).smash.inp (generated)

006040503.b3lyp_6-31g(d).nwchem.inp (generated) 006040503.b3lyp_6-31g(d).log.xz 006040503.td-b3lyp_6-31g+(d).inp 006040503.td-b3lyp_6-31g+(d).log.xz

006040503.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040503.td-b3lyp_6-31+g(d).gjf (generated)

006040503.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040503.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040503.mol 006040503.PUBCHEM 006040503.mol (via Jmol)
006040656.b3lyp_6-31g(d).inp

006040656.b3lyp_6-31g(d).qchem.inp (generated)

006040656.b3lyp_6-31g(d).gjf (generated)

006040656.b3lyp_6-31g(d).firefly.inp (generated)

006040656.b3lyp_6-31g(d).smash.inp (generated)

006040656.b3lyp_6-31g(d).nwchem.inp (generated) 006040656.b3lyp_6-31g(d).log.xz 006040656.td-b3lyp_6-31g+(d).inp 006040656.td-b3lyp_6-31g+(d).log.xz

006040656.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040656.td-b3lyp_6-31+g(d).gjf (generated)

006040656.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040656.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040656.mol 006040656.PUBCHEM 006040656.mol (via Jmol)
006040659.b3lyp_6-31g(d).inp

006040659.b3lyp_6-31g(d).qchem.inp (generated)

006040659.b3lyp_6-31g(d).gjf (generated)

006040659.b3lyp_6-31g(d).firefly.inp (generated)

006040659.b3lyp_6-31g(d).smash.inp (generated)

006040659.b3lyp_6-31g(d).nwchem.inp (generated) 006040659.b3lyp_6-31g(d).log.xz 006040659.td-b3lyp_6-31g+(d).inp 006040659.td-b3lyp_6-31g+(d).log.xz

006040659.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040659.td-b3lyp_6-31+g(d).gjf (generated)

006040659.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040659.mol 006040659.PUBCHEM 006040659.mol (via Jmol)
006040767.b3lyp_6-31g(d).inp

006040767.b3lyp_6-31g(d).qchem.inp (generated)

006040767.b3lyp_6-31g(d).gjf (generated)

006040767.b3lyp_6-31g(d).firefly.inp (generated)

006040767.b3lyp_6-31g(d).smash.inp (generated)

006040767.b3lyp_6-31g(d).nwchem.inp (generated) 006040767.b3lyp_6-31g(d).log.xz 006040767.td-b3lyp_6-31g+(d).inp 006040767.td-b3lyp_6-31g+(d).log.xz

006040767.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040767.td-b3lyp_6-31+g(d).gjf (generated)

006040767.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040767.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040767.mol 006040767.PUBCHEM 006040767.mol (via Jmol)
006040789.b3lyp_6-31g(d).inp

006040789.b3lyp_6-31g(d).qchem.inp (generated)

006040789.b3lyp_6-31g(d).gjf (generated)

006040789.b3lyp_6-31g(d).firefly.inp (generated)

006040789.b3lyp_6-31g(d).smash.inp (generated)

006040789.b3lyp_6-31g(d).nwchem.inp (generated) 006040789.b3lyp_6-31g(d).log.xz 006040789.td-b3lyp_6-31g+(d).inp 006040789.td-b3lyp_6-31g+(d).log.xz

006040789.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040789.td-b3lyp_6-31+g(d).gjf (generated)

006040789.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040789.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040789.mol 006040789.PUBCHEM 006040789.mol (via Jmol)
006040874.b3lyp_6-31g(d).inp

006040874.b3lyp_6-31g(d).qchem.inp (generated)

006040874.b3lyp_6-31g(d).gjf (generated)

006040874.b3lyp_6-31g(d).firefly.inp (generated)

006040874.b3lyp_6-31g(d).smash.inp (generated)

006040874.b3lyp_6-31g(d).nwchem.inp (generated) 006040874.b3lyp_6-31g(d).log.xz 006040874.td-b3lyp_6-31g+(d).inp 006040874.td-b3lyp_6-31g+(d).log.xz

006040874.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040874.td-b3lyp_6-31+g(d).gjf (generated)

006040874.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040874.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040874.mol 006040874.PUBCHEM 006040874.mol (via Jmol)
006040899.b3lyp_6-31g(d).inp

006040899.b3lyp_6-31g(d).qchem.inp (generated)

006040899.b3lyp_6-31g(d).gjf (generated)

006040899.b3lyp_6-31g(d).firefly.inp (generated)

006040899.b3lyp_6-31g(d).smash.inp (generated)

006040899.b3lyp_6-31g(d).nwchem.inp (generated) 006040899.b3lyp_6-31g(d).log.xz 006040899.td-b3lyp_6-31g+(d).inp 006040899.td-b3lyp_6-31g+(d).log.xz

006040899.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040899.td-b3lyp_6-31+g(d).gjf (generated)

006040899.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040899.mol 006040899.PUBCHEM 006040899.mol (via Jmol)
006040936.b3lyp_6-31g(d).inp

006040936.b3lyp_6-31g(d).qchem.inp (generated)

006040936.b3lyp_6-31g(d).gjf (generated)

006040936.b3lyp_6-31g(d).firefly.inp (generated)

006040936.b3lyp_6-31g(d).smash.inp (generated)

006040936.b3lyp_6-31g(d).nwchem.inp (generated) 006040936.b3lyp_6-31g(d).log.xz 006040936.td-b3lyp_6-31g+(d).inp 006040936.td-b3lyp_6-31g+(d).log.xz

006040936.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040936.td-b3lyp_6-31+g(d).gjf (generated)

006040936.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040936.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040936.mol 006040936.PUBCHEM 006040936.mol (via Jmol)
006040949.b3lyp_6-31g(d).inp

006040949.b3lyp_6-31g(d).qchem.inp (generated)

006040949.b3lyp_6-31g(d).gjf (generated)

006040949.b3lyp_6-31g(d).firefly.inp (generated)

006040949.b3lyp_6-31g(d).smash.inp (generated)

006040949.b3lyp_6-31g(d).nwchem.inp (generated) 006040949.b3lyp_6-31g(d).log.xz 006040949.td-b3lyp_6-31g+(d).inp 006040949.td-b3lyp_6-31g+(d).log.xz

006040949.td-b3lyp_6-31+g(d).qchem.inp (generated)

006040949.td-b3lyp_6-31+g(d).gjf (generated)

006040949.td-b3lyp_6-31+g(d).firefly.inp (generated)

006040949.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006040949.mol 006040949.PUBCHEM 006040949.mol (via Jmol)
006041013.b3lyp_6-31g(d).inp

006041013.b3lyp_6-31g(d).qchem.inp (generated)

006041013.b3lyp_6-31g(d).gjf (generated)

006041013.b3lyp_6-31g(d).firefly.inp (generated)

006041013.b3lyp_6-31g(d).smash.inp (generated)

006041013.b3lyp_6-31g(d).nwchem.inp (generated) 006041013.b3lyp_6-31g(d).log.xz 006041013.td-b3lyp_6-31g+(d).inp 006041013.td-b3lyp_6-31g+(d).log.xz

006041013.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041013.td-b3lyp_6-31+g(d).gjf (generated)

006041013.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041013.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041013.mol 006041013.PUBCHEM 006041013.mol (via Jmol)
006041059.b3lyp_6-31g(d).inp

006041059.b3lyp_6-31g(d).qchem.inp (generated)

006041059.b3lyp_6-31g(d).gjf (generated)

006041059.b3lyp_6-31g(d).firefly.inp (generated)

006041059.b3lyp_6-31g(d).smash.inp (generated)

006041059.b3lyp_6-31g(d).nwchem.inp (generated) 006041059.b3lyp_6-31g(d).log.xz 006041059.td-b3lyp_6-31g+(d).inp 006041059.td-b3lyp_6-31g+(d).log.xz

006041059.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041059.td-b3lyp_6-31+g(d).gjf (generated)

006041059.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041059.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041059.mol 006041059.PUBCHEM 006041059.mol (via Jmol)
006041362.b3lyp_6-31g(d).inp

006041362.b3lyp_6-31g(d).qchem.inp (generated)

006041362.b3lyp_6-31g(d).gjf (generated)

006041362.b3lyp_6-31g(d).firefly.inp (generated)

006041362.b3lyp_6-31g(d).smash.inp (generated)

006041362.b3lyp_6-31g(d).nwchem.inp (generated) 006041362.b3lyp_6-31g(d).log.xz 006041362.td-b3lyp_6-31g+(d).inp 006041362.td-b3lyp_6-31g+(d).log.xz

006041362.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041362.td-b3lyp_6-31+g(d).gjf (generated)

006041362.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041362.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041362.mol 006041362.PUBCHEM 006041362.mol (via Jmol)
006041440.b3lyp_6-31g(d).inp

006041440.b3lyp_6-31g(d).qchem.inp (generated)

006041440.b3lyp_6-31g(d).gjf (generated)

006041440.b3lyp_6-31g(d).firefly.inp (generated)

006041440.b3lyp_6-31g(d).smash.inp (generated)

006041440.b3lyp_6-31g(d).nwchem.inp (generated) 006041440.b3lyp_6-31g(d).log.xz 006041440.td-b3lyp_6-31g+(d).inp 006041440.td-b3lyp_6-31g+(d).log.xz

006041440.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041440.td-b3lyp_6-31+g(d).gjf (generated)

006041440.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041440.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041440.mol 006041440.PUBCHEM 006041440.mol (via Jmol)
006041510.b3lyp_6-31g(d).inp

006041510.b3lyp_6-31g(d).qchem.inp (generated)

006041510.b3lyp_6-31g(d).gjf (generated)

006041510.b3lyp_6-31g(d).firefly.inp (generated)

006041510.b3lyp_6-31g(d).smash.inp (generated)

006041510.b3lyp_6-31g(d).nwchem.inp (generated) 006041510.b3lyp_6-31g(d).log.xz 006041510.td-b3lyp_6-31g+(d).inp 006041510.td-b3lyp_6-31g+(d).log.xz

006041510.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041510.td-b3lyp_6-31+g(d).gjf (generated)

006041510.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041510.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041510.mol 006041510.PUBCHEM 006041510.mol (via Jmol)
006041531.b3lyp_6-31g(d).inp

006041531.b3lyp_6-31g(d).qchem.inp (generated)

006041531.b3lyp_6-31g(d).gjf (generated)

006041531.b3lyp_6-31g(d).firefly.inp (generated)

006041531.b3lyp_6-31g(d).smash.inp (generated)

006041531.b3lyp_6-31g(d).nwchem.inp (generated) 006041531.b3lyp_6-31g(d).log.xz 006041531.td-b3lyp_6-31g+(d).inp 006041531.td-b3lyp_6-31g+(d).log.xz

006041531.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041531.td-b3lyp_6-31+g(d).gjf (generated)

006041531.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041531.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041531.mol 006041531.PUBCHEM 006041531.mol (via Jmol)
006041622.b3lyp_6-31g(d).inp

006041622.b3lyp_6-31g(d).qchem.inp (generated)

006041622.b3lyp_6-31g(d).gjf (generated)

006041622.b3lyp_6-31g(d).firefly.inp (generated)

006041622.b3lyp_6-31g(d).smash.inp (generated)

006041622.b3lyp_6-31g(d).nwchem.inp (generated) 006041622.b3lyp_6-31g(d).log.xz 006041622.td-b3lyp_6-31g+(d).inp 006041622.td-b3lyp_6-31g+(d).log.xz

006041622.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041622.td-b3lyp_6-31+g(d).gjf (generated)

006041622.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041622.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041622.mol 006041622.PUBCHEM 006041622.mol (via Jmol)
006041661.b3lyp_6-31g(d).inp

006041661.b3lyp_6-31g(d).qchem.inp (generated)

006041661.b3lyp_6-31g(d).gjf (generated)

006041661.b3lyp_6-31g(d).firefly.inp (generated)

006041661.b3lyp_6-31g(d).smash.inp (generated)

006041661.b3lyp_6-31g(d).nwchem.inp (generated) 006041661.b3lyp_6-31g(d).log.xz 006041661.mol 006041661.PUBCHEM 006041661.mol (via Jmol)
006041669.b3lyp_6-31g(d).inp

006041669.b3lyp_6-31g(d).qchem.inp (generated)

006041669.b3lyp_6-31g(d).gjf (generated)

006041669.b3lyp_6-31g(d).firefly.inp (generated)

006041669.b3lyp_6-31g(d).smash.inp (generated)

006041669.b3lyp_6-31g(d).nwchem.inp (generated) 006041669.b3lyp_6-31g(d).log.xz 006041669.td-b3lyp_6-31g+(d).inp 006041669.td-b3lyp_6-31g+(d).log.xz

006041669.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041669.td-b3lyp_6-31+g(d).gjf (generated)

006041669.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041669.mol 006041669.PUBCHEM 006041669.mol (via Jmol)
006041748.b3lyp_6-31g(d).inp

006041748.b3lyp_6-31g(d).qchem.inp (generated)

006041748.b3lyp_6-31g(d).gjf (generated)

006041748.b3lyp_6-31g(d).firefly.inp (generated)

006041748.b3lyp_6-31g(d).smash.inp (generated)

006041748.b3lyp_6-31g(d).nwchem.inp (generated) 006041748.b3lyp_6-31g(d).log.xz 006041748.td-b3lyp_6-31g+(d).inp 006041748.td-b3lyp_6-31g+(d).log.xz

006041748.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041748.td-b3lyp_6-31+g(d).gjf (generated)

006041748.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041748.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041748.mol 006041748.PUBCHEM 006041748.mol (via Jmol)
006041839.b3lyp_6-31g(d).inp

006041839.b3lyp_6-31g(d).qchem.inp (generated)

006041839.b3lyp_6-31g(d).gjf (generated)

006041839.b3lyp_6-31g(d).firefly.inp (generated)

006041839.b3lyp_6-31g(d).smash.inp (generated)

006041839.b3lyp_6-31g(d).nwchem.inp (generated) 006041839.b3lyp_6-31g(d).log.xz 006041839.td-b3lyp_6-31g+(d).inp 006041839.td-b3lyp_6-31g+(d).log.xz

006041839.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041839.td-b3lyp_6-31+g(d).gjf (generated)

006041839.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041839.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041839.mol 006041839.PUBCHEM 006041839.mol (via Jmol)
006041840.b3lyp_6-31g(d).inp

006041840.b3lyp_6-31g(d).qchem.inp (generated)

006041840.b3lyp_6-31g(d).gjf (generated)

006041840.b3lyp_6-31g(d).firefly.inp (generated)

006041840.b3lyp_6-31g(d).smash.inp (generated)

006041840.b3lyp_6-31g(d).nwchem.inp (generated) 006041840.b3lyp_6-31g(d).log.xz 006041840.td-b3lyp_6-31g+(d).inp 006041840.td-b3lyp_6-31g+(d).log.xz

006041840.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041840.td-b3lyp_6-31+g(d).gjf (generated)

006041840.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041840.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041840.mol 006041840.PUBCHEM 006041840.mol (via Jmol)
006041877.b3lyp_6-31g(d).inp

006041877.b3lyp_6-31g(d).qchem.inp (generated)

006041877.b3lyp_6-31g(d).gjf (generated)

006041877.b3lyp_6-31g(d).firefly.inp (generated)

006041877.b3lyp_6-31g(d).smash.inp (generated)

006041877.b3lyp_6-31g(d).nwchem.inp (generated) 006041877.b3lyp_6-31g(d).log.xz 006041877.td-b3lyp_6-31g+(d).inp 006041877.td-b3lyp_6-31g+(d).log.xz

006041877.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041877.td-b3lyp_6-31+g(d).gjf (generated)

006041877.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041877.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041877.mol 006041877.PUBCHEM 006041877.mol (via Jmol)
006041911.b3lyp_6-31g(d).inp

006041911.b3lyp_6-31g(d).qchem.inp (generated)

006041911.b3lyp_6-31g(d).gjf (generated)

006041911.b3lyp_6-31g(d).firefly.inp (generated)

006041911.b3lyp_6-31g(d).smash.inp (generated)

006041911.b3lyp_6-31g(d).nwchem.inp (generated) 006041911.b3lyp_6-31g(d).log.xz 006041911.mol 006041911.PUBCHEM 006041911.mol (via Jmol)
006041946.b3lyp_6-31g(d).inp

006041946.b3lyp_6-31g(d).qchem.inp (generated)

006041946.b3lyp_6-31g(d).gjf (generated)

006041946.b3lyp_6-31g(d).firefly.inp (generated)

006041946.b3lyp_6-31g(d).smash.inp (generated)

006041946.b3lyp_6-31g(d).nwchem.inp (generated) 006041946.b3lyp_6-31g(d).log.xz 006041946.mol 006041946.PUBCHEM 006041946.mol (via Jmol)
006041972.b3lyp_6-31g(d).inp

006041972.b3lyp_6-31g(d).qchem.inp (generated)

006041972.b3lyp_6-31g(d).gjf (generated)

006041972.b3lyp_6-31g(d).firefly.inp (generated)

006041972.b3lyp_6-31g(d).smash.inp (generated)

006041972.b3lyp_6-31g(d).nwchem.inp (generated) 006041972.b3lyp_6-31g(d).log.xz 006041972.td-b3lyp_6-31g+(d).inp 006041972.td-b3lyp_6-31g+(d).log.xz

006041972.td-b3lyp_6-31+g(d).qchem.inp (generated)

006041972.td-b3lyp_6-31+g(d).gjf (generated)

006041972.td-b3lyp_6-31+g(d).firefly.inp (generated)

006041972.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006041972.mol 006041972.PUBCHEM 006041972.mol (via Jmol)
006042275.b3lyp_6-31g(d).inp

006042275.b3lyp_6-31g(d).qchem.inp (generated)

006042275.b3lyp_6-31g(d).gjf (generated)

006042275.b3lyp_6-31g(d).firefly.inp (generated)

006042275.b3lyp_6-31g(d).smash.inp (generated)

006042275.b3lyp_6-31g(d).nwchem.inp (generated) 006042275.b3lyp_6-31g(d).log.xz 006042275.mol 006042275.PUBCHEM 006042275.mol (via Jmol)
006042277.b3lyp_6-31g(d).inp

006042277.b3lyp_6-31g(d).qchem.inp (generated)

006042277.b3lyp_6-31g(d).gjf (generated)

006042277.b3lyp_6-31g(d).firefly.inp (generated)

006042277.b3lyp_6-31g(d).smash.inp (generated)

006042277.b3lyp_6-31g(d).nwchem.inp (generated) 006042277.b3lyp_6-31g(d).log.xz 006042277.td-b3lyp_6-31g+(d).inp 006042277.td-b3lyp_6-31g+(d).log.xz

006042277.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042277.td-b3lyp_6-31+g(d).gjf (generated)

006042277.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042277.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042277.mol 006042277.PUBCHEM 006042277.mol (via Jmol)
006042350.b3lyp_6-31g(d).inp

006042350.b3lyp_6-31g(d).qchem.inp (generated)

006042350.b3lyp_6-31g(d).gjf (generated)

006042350.b3lyp_6-31g(d).firefly.inp (generated)

006042350.b3lyp_6-31g(d).smash.inp (generated)

006042350.b3lyp_6-31g(d).nwchem.inp (generated) 006042350.b3lyp_6-31g(d).log.xz 006042350.td-b3lyp_6-31g+(d).inp 006042350.td-b3lyp_6-31g+(d).log.xz

006042350.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042350.td-b3lyp_6-31+g(d).gjf (generated)

006042350.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042350.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042350.mol 006042350.PUBCHEM 006042350.mol (via Jmol)
006042351.b3lyp_6-31g(d).inp

006042351.b3lyp_6-31g(d).qchem.inp (generated)

006042351.b3lyp_6-31g(d).gjf (generated)

006042351.b3lyp_6-31g(d).firefly.inp (generated)

006042351.b3lyp_6-31g(d).smash.inp (generated)

006042351.b3lyp_6-31g(d).nwchem.inp (generated) 006042351.b3lyp_6-31g(d).log.xz 006042351.mol 006042351.PUBCHEM 006042351.mol (via Jmol)
006042414.b3lyp_6-31g(d).inp

006042414.b3lyp_6-31g(d).qchem.inp (generated)

006042414.b3lyp_6-31g(d).gjf (generated)

006042414.b3lyp_6-31g(d).firefly.inp (generated)

006042414.b3lyp_6-31g(d).smash.inp (generated)

006042414.b3lyp_6-31g(d).nwchem.inp (generated) 006042414.b3lyp_6-31g(d).log.xz 006042414.td-b3lyp_6-31g+(d).inp 006042414.td-b3lyp_6-31g+(d).log.xz

006042414.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042414.td-b3lyp_6-31+g(d).gjf (generated)

006042414.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042414.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042414.mol 006042414.PUBCHEM 006042414.mol (via Jmol)
006042445.b3lyp_6-31g(d).inp

006042445.b3lyp_6-31g(d).qchem.inp (generated)

006042445.b3lyp_6-31g(d).gjf (generated)

006042445.b3lyp_6-31g(d).firefly.inp (generated)

006042445.b3lyp_6-31g(d).smash.inp (generated)

006042445.b3lyp_6-31g(d).nwchem.inp (generated) 006042445.b3lyp_6-31g(d).log.xz 006042445.mol 006042445.PUBCHEM 006042445.mol (via Jmol)
006042467.b3lyp_6-31g(d).inp

006042467.b3lyp_6-31g(d).qchem.inp (generated)

006042467.b3lyp_6-31g(d).gjf (generated)

006042467.b3lyp_6-31g(d).firefly.inp (generated)

006042467.b3lyp_6-31g(d).smash.inp (generated)

006042467.b3lyp_6-31g(d).nwchem.inp (generated) 006042467.b3lyp_6-31g(d).log.xz 006042467.td-b3lyp_6-31g+(d).inp 006042467.td-b3lyp_6-31g+(d).log.xz

006042467.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042467.td-b3lyp_6-31+g(d).gjf (generated)

006042467.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042467.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042467.mol 006042467.PUBCHEM 006042467.mol (via Jmol)
006042485.b3lyp_6-31g(d).inp

006042485.b3lyp_6-31g(d).qchem.inp (generated)

006042485.b3lyp_6-31g(d).gjf (generated)

006042485.b3lyp_6-31g(d).firefly.inp (generated)

006042485.b3lyp_6-31g(d).smash.inp (generated)

006042485.b3lyp_6-31g(d).nwchem.inp (generated) 006042485.b3lyp_6-31g(d).log.xz 006042485.td-b3lyp_6-31g+(d).inp 006042485.td-b3lyp_6-31g+(d).log.xz

006042485.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042485.td-b3lyp_6-31+g(d).gjf (generated)

006042485.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042485.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042485.mol 006042485.PUBCHEM 006042485.mol (via Jmol)
006042519.b3lyp_6-31g(d).inp

006042519.b3lyp_6-31g(d).qchem.inp (generated)

006042519.b3lyp_6-31g(d).gjf (generated)

006042519.b3lyp_6-31g(d).firefly.inp (generated)

006042519.b3lyp_6-31g(d).smash.inp (generated)

006042519.b3lyp_6-31g(d).nwchem.inp (generated) 006042519.b3lyp_6-31g(d).log.xz 006042519.td-b3lyp_6-31g+(d).inp 006042519.td-b3lyp_6-31g+(d).log.xz

006042519.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042519.td-b3lyp_6-31+g(d).gjf (generated)

006042519.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042519.mol 006042519.PUBCHEM 006042519.mol (via Jmol)
006042575.b3lyp_6-31g(d).inp

006042575.b3lyp_6-31g(d).qchem.inp (generated)

006042575.b3lyp_6-31g(d).gjf (generated)

006042575.b3lyp_6-31g(d).firefly.inp (generated)

006042575.b3lyp_6-31g(d).smash.inp (generated)

006042575.b3lyp_6-31g(d).nwchem.inp (generated) 006042575.b3lyp_6-31g(d).log.xz 006042575.td-b3lyp_6-31g+(d).inp 006042575.td-b3lyp_6-31g+(d).log.xz

006042575.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042575.td-b3lyp_6-31+g(d).gjf (generated)

006042575.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042575.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042575.mol 006042575.PUBCHEM 006042575.mol (via Jmol)
006042611.b3lyp_6-31g(d).inp

006042611.b3lyp_6-31g(d).qchem.inp (generated)

006042611.b3lyp_6-31g(d).gjf (generated)

006042611.b3lyp_6-31g(d).firefly.inp (generated)

006042611.b3lyp_6-31g(d).smash.inp (generated)

006042611.b3lyp_6-31g(d).nwchem.inp (generated) 006042611.b3lyp_6-31g(d).log.xz 006042611.td-b3lyp_6-31g+(d).inp 006042611.td-b3lyp_6-31g+(d).log.xz

006042611.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042611.td-b3lyp_6-31+g(d).gjf (generated)

006042611.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042611.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042611.mol 006042611.PUBCHEM 006042611.mol (via Jmol)
006042642.b3lyp_6-31g(d).inp

006042642.b3lyp_6-31g(d).qchem.inp (generated)

006042642.b3lyp_6-31g(d).gjf (generated)

006042642.b3lyp_6-31g(d).firefly.inp (generated)

006042642.b3lyp_6-31g(d).smash.inp (generated)

006042642.b3lyp_6-31g(d).nwchem.inp (generated) 006042642.b3lyp_6-31g(d).log.xz 006042642.td-b3lyp_6-31g+(d).inp 006042642.td-b3lyp_6-31g+(d).log.xz

006042642.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042642.td-b3lyp_6-31+g(d).gjf (generated)

006042642.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042642.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042642.mol 006042642.PUBCHEM 006042642.mol (via Jmol)
006042737.b3lyp_6-31g(d).inp

006042737.b3lyp_6-31g(d).qchem.inp (generated)

006042737.b3lyp_6-31g(d).gjf (generated)

006042737.b3lyp_6-31g(d).firefly.inp (generated)

006042737.b3lyp_6-31g(d).smash.inp (generated)

006042737.b3lyp_6-31g(d).nwchem.inp (generated) 006042737.b3lyp_6-31g(d).log.xz 006042737.td-b3lyp_6-31g+(d).inp 006042737.td-b3lyp_6-31g+(d).log.xz

006042737.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042737.td-b3lyp_6-31+g(d).gjf (generated)

006042737.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042737.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042737.mol 006042737.PUBCHEM 006042737.mol (via Jmol)
006042818.b3lyp_6-31g(d).inp

006042818.b3lyp_6-31g(d).qchem.inp (generated)

006042818.b3lyp_6-31g(d).gjf (generated)

006042818.b3lyp_6-31g(d).firefly.inp (generated)

006042818.b3lyp_6-31g(d).smash.inp (generated)

006042818.b3lyp_6-31g(d).nwchem.inp (generated) 006042818.b3lyp_6-31g(d).log.xz 006042818.td-b3lyp_6-31g+(d).inp 006042818.td-b3lyp_6-31g+(d).log.xz

006042818.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042818.td-b3lyp_6-31+g(d).gjf (generated)

006042818.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042818.mol 006042818.PUBCHEM 006042818.mol (via Jmol)
006042879.b3lyp_6-31g(d).inp

006042879.b3lyp_6-31g(d).qchem.inp (generated)

006042879.b3lyp_6-31g(d).gjf (generated)

006042879.b3lyp_6-31g(d).firefly.inp (generated)

006042879.b3lyp_6-31g(d).smash.inp (generated)

006042879.b3lyp_6-31g(d).nwchem.inp (generated) 006042879.b3lyp_6-31g(d).log.xz 006042879.mol 006042879.PUBCHEM 006042879.mol (via Jmol)
006042885.b3lyp_6-31g(d).inp

006042885.b3lyp_6-31g(d).qchem.inp (generated)

006042885.b3lyp_6-31g(d).gjf (generated)

006042885.b3lyp_6-31g(d).firefly.inp (generated)

006042885.b3lyp_6-31g(d).smash.inp (generated)

006042885.b3lyp_6-31g(d).nwchem.inp (generated) 006042885.b3lyp_6-31g(d).log.xz 006042885.td-b3lyp_6-31g+(d).inp 006042885.td-b3lyp_6-31g+(d).log.xz

006042885.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042885.td-b3lyp_6-31+g(d).gjf (generated)

006042885.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042885.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042885.mol 006042885.PUBCHEM 006042885.mol (via Jmol)
006042896.b3lyp_6-31g(d).inp

006042896.b3lyp_6-31g(d).qchem.inp (generated)

006042896.b3lyp_6-31g(d).gjf (generated)

006042896.b3lyp_6-31g(d).firefly.inp (generated)

006042896.b3lyp_6-31g(d).smash.inp (generated)

006042896.b3lyp_6-31g(d).nwchem.inp (generated) 006042896.b3lyp_6-31g(d).log.xz 006042896.mol 006042896.PUBCHEM 006042896.mol (via Jmol)
006042912.b3lyp_6-31g(d).inp

006042912.b3lyp_6-31g(d).qchem.inp (generated)

006042912.b3lyp_6-31g(d).gjf (generated)

006042912.b3lyp_6-31g(d).firefly.inp (generated)

006042912.b3lyp_6-31g(d).smash.inp (generated)

006042912.b3lyp_6-31g(d).nwchem.inp (generated) 006042912.b3lyp_6-31g(d).log.xz 006042912.td-b3lyp_6-31g+(d).inp 006042912.td-b3lyp_6-31g+(d).log.xz

006042912.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042912.td-b3lyp_6-31+g(d).gjf (generated)

006042912.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042912.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042912.mol 006042912.PUBCHEM 006042912.mol (via Jmol)
006042944.b3lyp_6-31g(d).inp

006042944.b3lyp_6-31g(d).qchem.inp (generated)

006042944.b3lyp_6-31g(d).gjf (generated)

006042944.b3lyp_6-31g(d).firefly.inp (generated)

006042944.b3lyp_6-31g(d).smash.inp (generated)

006042944.b3lyp_6-31g(d).nwchem.inp (generated) 006042944.b3lyp_6-31g(d).log.xz 006042944.td-b3lyp_6-31g+(d).inp 006042944.td-b3lyp_6-31g+(d).log.xz

006042944.td-b3lyp_6-31+g(d).qchem.inp (generated)

006042944.td-b3lyp_6-31+g(d).gjf (generated)

006042944.td-b3lyp_6-31+g(d).firefly.inp (generated)

006042944.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006042944.mol 006042944.PUBCHEM 006042944.mol (via Jmol)
006043019.b3lyp_6-31g(d).inp

006043019.b3lyp_6-31g(d).qchem.inp (generated)

006043019.b3lyp_6-31g(d).gjf (generated)

006043019.b3lyp_6-31g(d).firefly.inp (generated)

006043019.b3lyp_6-31g(d).smash.inp (generated)

006043019.b3lyp_6-31g(d).nwchem.inp (generated) 006043019.b3lyp_6-31g(d).log.xz 006043019.td-b3lyp_6-31g+(d).inp 006043019.td-b3lyp_6-31g+(d).log.xz

006043019.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043019.td-b3lyp_6-31+g(d).gjf (generated)

006043019.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043019.mol 006043019.PUBCHEM 006043019.mol (via Jmol)
006043063.b3lyp_6-31g(d).inp

006043063.b3lyp_6-31g(d).qchem.inp (generated)

006043063.b3lyp_6-31g(d).gjf (generated)

006043063.b3lyp_6-31g(d).firefly.inp (generated)

006043063.b3lyp_6-31g(d).smash.inp (generated)

006043063.b3lyp_6-31g(d).nwchem.inp (generated) 006043063.b3lyp_6-31g(d).log.xz 006043063.td-b3lyp_6-31g+(d).inp 006043063.td-b3lyp_6-31g+(d).log.xz

006043063.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043063.td-b3lyp_6-31+g(d).gjf (generated)

006043063.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043063.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043063.mol 006043063.PUBCHEM 006043063.mol (via Jmol)
006043267.b3lyp_6-31g(d).inp

006043267.b3lyp_6-31g(d).qchem.inp (generated)

006043267.b3lyp_6-31g(d).gjf (generated)

006043267.b3lyp_6-31g(d).firefly.inp (generated)

006043267.b3lyp_6-31g(d).smash.inp (generated)

006043267.b3lyp_6-31g(d).nwchem.inp (generated) 006043267.b3lyp_6-31g(d).log.xz 006043267.td-b3lyp_6-31g+(d).inp 006043267.td-b3lyp_6-31g+(d).log.xz

006043267.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043267.td-b3lyp_6-31+g(d).gjf (generated)

006043267.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043267.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043267.mol 006043267.PUBCHEM 006043267.mol (via Jmol)
006043304.b3lyp_6-31g(d).inp

006043304.b3lyp_6-31g(d).qchem.inp (generated)

006043304.b3lyp_6-31g(d).gjf (generated)

006043304.b3lyp_6-31g(d).firefly.inp (generated)

006043304.b3lyp_6-31g(d).smash.inp (generated)

006043304.b3lyp_6-31g(d).nwchem.inp (generated) 006043304.b3lyp_6-31g(d).log.xz 006043304.td-b3lyp_6-31g+(d).inp 006043304.td-b3lyp_6-31g+(d).log.xz

006043304.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043304.td-b3lyp_6-31+g(d).gjf (generated)

006043304.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043304.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043304.mol 006043304.PUBCHEM 006043304.mol (via Jmol)
006043561.b3lyp_6-31g(d).inp

006043561.b3lyp_6-31g(d).qchem.inp (generated)

006043561.b3lyp_6-31g(d).gjf (generated)

006043561.b3lyp_6-31g(d).firefly.inp (generated)

006043561.b3lyp_6-31g(d).smash.inp (generated)

006043561.b3lyp_6-31g(d).nwchem.inp (generated) 006043561.b3lyp_6-31g(d).log.xz 006043561.td-b3lyp_6-31g+(d).inp 006043561.td-b3lyp_6-31g+(d).log.xz

006043561.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043561.td-b3lyp_6-31+g(d).gjf (generated)

006043561.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043561.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043561.mol 006043561.PUBCHEM 006043561.mol (via Jmol)
006043600.b3lyp_6-31g(d).inp

006043600.b3lyp_6-31g(d).qchem.inp (generated)

006043600.b3lyp_6-31g(d).gjf (generated)

006043600.b3lyp_6-31g(d).firefly.inp (generated)

006043600.b3lyp_6-31g(d).smash.inp (generated)

006043600.b3lyp_6-31g(d).nwchem.inp (generated) 006043600.b3lyp_6-31g(d).log.xz 006043600.td-b3lyp_6-31g+(d).inp 006043600.td-b3lyp_6-31g+(d).log.xz

006043600.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043600.td-b3lyp_6-31+g(d).gjf (generated)

006043600.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043600.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043600.mol 006043600.PUBCHEM 006043600.mol (via Jmol)
006043657.b3lyp_6-31g(d).inp

006043657.b3lyp_6-31g(d).qchem.inp (generated)

006043657.b3lyp_6-31g(d).gjf (generated)

006043657.b3lyp_6-31g(d).firefly.inp (generated)

006043657.b3lyp_6-31g(d).smash.inp (generated)

006043657.b3lyp_6-31g(d).nwchem.inp (generated) 006043657.b3lyp_6-31g(d).log.xz 006043657.td-b3lyp_6-31g+(d).inp 006043657.td-b3lyp_6-31g+(d).log.xz

006043657.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043657.td-b3lyp_6-31+g(d).gjf (generated)

006043657.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043657.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043657.mol 006043657.PUBCHEM 006043657.mol (via Jmol)
006043669.b3lyp_6-31g(d).inp

006043669.b3lyp_6-31g(d).qchem.inp (generated)

006043669.b3lyp_6-31g(d).gjf (generated)

006043669.b3lyp_6-31g(d).firefly.inp (generated)

006043669.b3lyp_6-31g(d).smash.inp (generated)

006043669.b3lyp_6-31g(d).nwchem.inp (generated) 006043669.b3lyp_6-31g(d).log.xz 006043669.td-b3lyp_6-31g+(d).inp 006043669.td-b3lyp_6-31g+(d).log.xz

006043669.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043669.td-b3lyp_6-31+g(d).gjf (generated)

006043669.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043669.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043669.mol 006043669.PUBCHEM 006043669.mol (via Jmol)
006043704.b3lyp_6-31g(d).inp

006043704.b3lyp_6-31g(d).qchem.inp (generated)

006043704.b3lyp_6-31g(d).gjf (generated)

006043704.b3lyp_6-31g(d).firefly.inp (generated)

006043704.b3lyp_6-31g(d).smash.inp (generated)

006043704.b3lyp_6-31g(d).nwchem.inp (generated) 006043704.b3lyp_6-31g(d).log.xz 006043704.td-b3lyp_6-31g+(d).inp 006043704.td-b3lyp_6-31g+(d).log.xz

006043704.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043704.td-b3lyp_6-31+g(d).gjf (generated)

006043704.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043704.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043704.mol 006043704.PUBCHEM 006043704.mol (via Jmol)
006043708.b3lyp_6-31g(d).inp

006043708.b3lyp_6-31g(d).qchem.inp (generated)

006043708.b3lyp_6-31g(d).gjf (generated)

006043708.b3lyp_6-31g(d).firefly.inp (generated)

006043708.b3lyp_6-31g(d).smash.inp (generated)

006043708.b3lyp_6-31g(d).nwchem.inp (generated) 006043708.b3lyp_6-31g(d).log.xz 006043708.td-b3lyp_6-31g+(d).inp 006043708.td-b3lyp_6-31g+(d).log.xz

006043708.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043708.td-b3lyp_6-31+g(d).gjf (generated)

006043708.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043708.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043708.mol 006043708.PUBCHEM 006043708.mol (via Jmol)
006043810.b3lyp_6-31g(d).inp

006043810.b3lyp_6-31g(d).qchem.inp (generated)

006043810.b3lyp_6-31g(d).gjf (generated)

006043810.b3lyp_6-31g(d).firefly.inp (generated)

006043810.b3lyp_6-31g(d).smash.inp (generated)

006043810.b3lyp_6-31g(d).nwchem.inp (generated) 006043810.b3lyp_6-31g(d).log.xz 006043810.td-b3lyp_6-31g+(d).inp 006043810.td-b3lyp_6-31g+(d).log.xz

006043810.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043810.td-b3lyp_6-31+g(d).gjf (generated)

006043810.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043810.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043810.mol 006043810.PUBCHEM 006043810.mol (via Jmol)
006043824.b3lyp_6-31g(d).inp

006043824.b3lyp_6-31g(d).qchem.inp (generated)

006043824.b3lyp_6-31g(d).gjf (generated)

006043824.b3lyp_6-31g(d).firefly.inp (generated)

006043824.b3lyp_6-31g(d).smash.inp (generated)

006043824.b3lyp_6-31g(d).nwchem.inp (generated) 006043824.b3lyp_6-31g(d).log.xz 006043824.td-b3lyp_6-31g+(d).inp 006043824.td-b3lyp_6-31g+(d).log.xz

006043824.td-b3lyp_6-31+g(d).qchem.inp (generated)

006043824.td-b3lyp_6-31+g(d).gjf (generated)

006043824.td-b3lyp_6-31+g(d).firefly.inp (generated)

006043824.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006043824.mol 006043824.PUBCHEM 006043824.mol (via Jmol)
006044189.b3lyp_6-31g(d).inp

006044189.b3lyp_6-31g(d).qchem.inp (generated)

006044189.b3lyp_6-31g(d).gjf (generated)

006044189.b3lyp_6-31g(d).firefly.inp (generated)

006044189.b3lyp_6-31g(d).smash.inp (generated)

006044189.b3lyp_6-31g(d).nwchem.inp (generated) 006044189.b3lyp_6-31g(d).log.xz 006044189.td-b3lyp_6-31g+(d).inp 006044189.td-b3lyp_6-31g+(d).log.xz

006044189.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044189.td-b3lyp_6-31+g(d).gjf (generated)

006044189.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044189.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044189.mol 006044189.PUBCHEM 006044189.mol (via Jmol)
006044248.b3lyp_6-31g(d).inp

006044248.b3lyp_6-31g(d).qchem.inp (generated)

006044248.b3lyp_6-31g(d).gjf (generated)

006044248.b3lyp_6-31g(d).firefly.inp (generated)

006044248.b3lyp_6-31g(d).smash.inp (generated)

006044248.b3lyp_6-31g(d).nwchem.inp (generated) 006044248.b3lyp_6-31g(d).log.xz 006044248.td-b3lyp_6-31g+(d).inp 006044248.td-b3lyp_6-31g+(d).log.xz

006044248.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044248.td-b3lyp_6-31+g(d).gjf (generated)

006044248.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044248.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044248.mol 006044248.PUBCHEM 006044248.mol (via Jmol)
006044659.b3lyp_6-31g(d).inp

006044659.b3lyp_6-31g(d).qchem.inp (generated)

006044659.b3lyp_6-31g(d).gjf (generated)

006044659.b3lyp_6-31g(d).firefly.inp (generated)

006044659.b3lyp_6-31g(d).smash.inp (generated)

006044659.b3lyp_6-31g(d).nwchem.inp (generated) 006044659.b3lyp_6-31g(d).log.xz 006044659.td-b3lyp_6-31g+(d).inp 006044659.td-b3lyp_6-31g+(d).log.xz

006044659.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044659.td-b3lyp_6-31+g(d).gjf (generated)

006044659.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044659.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044659.mol 006044659.PUBCHEM 006044659.mol (via Jmol)
006044711.b3lyp_6-31g(d).inp

006044711.b3lyp_6-31g(d).qchem.inp (generated)

006044711.b3lyp_6-31g(d).gjf (generated)

006044711.b3lyp_6-31g(d).firefly.inp (generated)

006044711.b3lyp_6-31g(d).smash.inp (generated)

006044711.b3lyp_6-31g(d).nwchem.inp (generated) 006044711.b3lyp_6-31g(d).log.xz 006044711.td-b3lyp_6-31g+(d).inp 006044711.td-b3lyp_6-31g+(d).log.xz

006044711.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044711.td-b3lyp_6-31+g(d).gjf (generated)

006044711.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044711.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044711.mol 006044711.PUBCHEM 006044711.mol (via Jmol)
006044724.b3lyp_6-31g(d).inp

006044724.b3lyp_6-31g(d).qchem.inp (generated)

006044724.b3lyp_6-31g(d).gjf (generated)

006044724.b3lyp_6-31g(d).firefly.inp (generated)

006044724.b3lyp_6-31g(d).smash.inp (generated)

006044724.b3lyp_6-31g(d).nwchem.inp (generated) 006044724.b3lyp_6-31g(d).log.xz 006044724.mol 006044724.PUBCHEM 006044724.mol (via Jmol)
006044821.b3lyp_6-31g(d).inp

006044821.b3lyp_6-31g(d).qchem.inp (generated)

006044821.b3lyp_6-31g(d).gjf (generated)

006044821.b3lyp_6-31g(d).firefly.inp (generated)

006044821.b3lyp_6-31g(d).smash.inp (generated)

006044821.b3lyp_6-31g(d).nwchem.inp (generated) 006044821.b3lyp_6-31g(d).log.xz 006044821.td-b3lyp_6-31g+(d).inp 006044821.td-b3lyp_6-31g+(d).log.xz

006044821.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044821.td-b3lyp_6-31+g(d).gjf (generated)

006044821.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044821.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044821.mol 006044821.PUBCHEM 006044821.mol (via Jmol)
006044881.b3lyp_6-31g(d).inp

006044881.b3lyp_6-31g(d).qchem.inp (generated)

006044881.b3lyp_6-31g(d).gjf (generated)

006044881.b3lyp_6-31g(d).firefly.inp (generated)

006044881.b3lyp_6-31g(d).smash.inp (generated)

006044881.b3lyp_6-31g(d).nwchem.inp (generated) 006044881.b3lyp_6-31g(d).log.xz 006044881.td-b3lyp_6-31g+(d).inp 006044881.td-b3lyp_6-31g+(d).log.xz

006044881.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044881.td-b3lyp_6-31+g(d).gjf (generated)

006044881.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044881.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044881.mol 006044881.PUBCHEM 006044881.mol (via Jmol)
006044934.b3lyp_6-31g(d).inp

006044934.b3lyp_6-31g(d).qchem.inp (generated)

006044934.b3lyp_6-31g(d).gjf (generated)

006044934.b3lyp_6-31g(d).firefly.inp (generated)

006044934.b3lyp_6-31g(d).smash.inp (generated)

006044934.b3lyp_6-31g(d).nwchem.inp (generated) 006044934.b3lyp_6-31g(d).log.xz 006044934.td-b3lyp_6-31g+(d).inp 006044934.td-b3lyp_6-31g+(d).log.xz

006044934.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044934.td-b3lyp_6-31+g(d).gjf (generated)

006044934.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044934.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044934.mol 006044934.PUBCHEM 006044934.mol (via Jmol)
006044952.b3lyp_6-31g(d).inp

006044952.b3lyp_6-31g(d).qchem.inp (generated)

006044952.b3lyp_6-31g(d).gjf (generated)

006044952.b3lyp_6-31g(d).firefly.inp (generated)

006044952.b3lyp_6-31g(d).smash.inp (generated)

006044952.b3lyp_6-31g(d).nwchem.inp (generated) 006044952.b3lyp_6-31g(d).log.xz 006044952.td-b3lyp_6-31g+(d).inp 006044952.td-b3lyp_6-31g+(d).log.xz

006044952.td-b3lyp_6-31+g(d).qchem.inp (generated)

006044952.td-b3lyp_6-31+g(d).gjf (generated)

006044952.td-b3lyp_6-31+g(d).firefly.inp (generated)

006044952.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006044952.mol 006044952.PUBCHEM 006044952.mol (via Jmol)
006045203.b3lyp_6-31g(d).inp

006045203.b3lyp_6-31g(d).qchem.inp (generated)

006045203.b3lyp_6-31g(d).gjf (generated)

006045203.b3lyp_6-31g(d).firefly.inp (generated)

006045203.b3lyp_6-31g(d).smash.inp (generated)

006045203.b3lyp_6-31g(d).nwchem.inp (generated) 006045203.b3lyp_6-31g(d).log.xz 006045203.td-b3lyp_6-31g+(d).inp 006045203.td-b3lyp_6-31g+(d).log.xz

006045203.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045203.td-b3lyp_6-31+g(d).gjf (generated)

006045203.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045203.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045203.mol 006045203.PUBCHEM 006045203.mol (via Jmol)
006045260.b3lyp_6-31g(d).inp

006045260.b3lyp_6-31g(d).qchem.inp (generated)

006045260.b3lyp_6-31g(d).gjf (generated)

006045260.b3lyp_6-31g(d).firefly.inp (generated)

006045260.b3lyp_6-31g(d).smash.inp (generated)

006045260.b3lyp_6-31g(d).nwchem.inp (generated) 006045260.b3lyp_6-31g(d).log.xz 006045260.td-b3lyp_6-31g+(d).inp 006045260.td-b3lyp_6-31g+(d).log.xz

006045260.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045260.td-b3lyp_6-31+g(d).gjf (generated)

006045260.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045260.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045260.mol 006045260.PUBCHEM 006045260.mol (via Jmol)
006045269.b3lyp_6-31g(d).inp

006045269.b3lyp_6-31g(d).qchem.inp (generated)

006045269.b3lyp_6-31g(d).gjf (generated)

006045269.b3lyp_6-31g(d).firefly.inp (generated)

006045269.b3lyp_6-31g(d).smash.inp (generated)

006045269.b3lyp_6-31g(d).nwchem.inp (generated) 006045269.b3lyp_6-31g(d).log.xz 006045269.td-b3lyp_6-31g+(d).inp 006045269.td-b3lyp_6-31g+(d).log.xz

006045269.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045269.td-b3lyp_6-31+g(d).gjf (generated)

006045269.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045269.mol 006045269.PUBCHEM 006045269.mol (via Jmol)
006045273.b3lyp_6-31g(d).inp

006045273.b3lyp_6-31g(d).qchem.inp (generated)

006045273.b3lyp_6-31g(d).gjf (generated)

006045273.b3lyp_6-31g(d).firefly.inp (generated)

006045273.b3lyp_6-31g(d).smash.inp (generated)

006045273.b3lyp_6-31g(d).nwchem.inp (generated) 006045273.b3lyp_6-31g(d).log.xz 006045273.td-b3lyp_6-31g+(d).inp 006045273.td-b3lyp_6-31g+(d).log.xz

006045273.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045273.td-b3lyp_6-31+g(d).gjf (generated)

006045273.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045273.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045273.mol 006045273.PUBCHEM 006045273.mol (via Jmol)
006045346.b3lyp_6-31g(d).inp

006045346.b3lyp_6-31g(d).qchem.inp (generated)

006045346.b3lyp_6-31g(d).gjf (generated)

006045346.b3lyp_6-31g(d).firefly.inp (generated)

006045346.b3lyp_6-31g(d).smash.inp (generated)

006045346.b3lyp_6-31g(d).nwchem.inp (generated) 006045346.b3lyp_6-31g(d).log.xz 006045346.td-b3lyp_6-31g+(d).inp 006045346.td-b3lyp_6-31g+(d).log.xz

006045346.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045346.td-b3lyp_6-31+g(d).gjf (generated)

006045346.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045346.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045346.mol 006045346.PUBCHEM 006045346.mol (via Jmol)
006045355.b3lyp_6-31g(d).inp

006045355.b3lyp_6-31g(d).qchem.inp (generated)

006045355.b3lyp_6-31g(d).gjf (generated)

006045355.b3lyp_6-31g(d).firefly.inp (generated)

006045355.b3lyp_6-31g(d).smash.inp (generated)

006045355.b3lyp_6-31g(d).nwchem.inp (generated) 006045355.b3lyp_6-31g(d).log.xz 006045355.td-b3lyp_6-31g+(d).inp 006045355.td-b3lyp_6-31g+(d).log.xz

006045355.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045355.td-b3lyp_6-31+g(d).gjf (generated)

006045355.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045355.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045355.mol 006045355.PUBCHEM 006045355.mol (via Jmol)
006045428.b3lyp_6-31g(d).inp

006045428.b3lyp_6-31g(d).qchem.inp (generated)

006045428.b3lyp_6-31g(d).gjf (generated)

006045428.b3lyp_6-31g(d).firefly.inp (generated)

006045428.b3lyp_6-31g(d).smash.inp (generated)

006045428.b3lyp_6-31g(d).nwchem.inp (generated) 006045428.b3lyp_6-31g(d).log.xz 006045428.td-b3lyp_6-31g+(d).inp 006045428.td-b3lyp_6-31g+(d).log.xz

006045428.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045428.td-b3lyp_6-31+g(d).gjf (generated)

006045428.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045428.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045428.mol 006045428.PUBCHEM 006045428.mol (via Jmol)
006045488.b3lyp_6-31g(d).inp

006045488.b3lyp_6-31g(d).qchem.inp (generated)

006045488.b3lyp_6-31g(d).gjf (generated)

006045488.b3lyp_6-31g(d).firefly.inp (generated)

006045488.b3lyp_6-31g(d).smash.inp (generated)

006045488.b3lyp_6-31g(d).nwchem.inp (generated) 006045488.b3lyp_6-31g(d).log.xz 006045488.td-b3lyp_6-31g+(d).inp 006045488.td-b3lyp_6-31g+(d).log.xz

006045488.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045488.td-b3lyp_6-31+g(d).gjf (generated)

006045488.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045488.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045488.mol 006045488.PUBCHEM 006045488.mol (via Jmol)
006045502.b3lyp_6-31g(d).inp

006045502.b3lyp_6-31g(d).qchem.inp (generated)

006045502.b3lyp_6-31g(d).gjf (generated)

006045502.b3lyp_6-31g(d).firefly.inp (generated)

006045502.b3lyp_6-31g(d).smash.inp (generated)

006045502.b3lyp_6-31g(d).nwchem.inp (generated) 006045502.b3lyp_6-31g(d).log.xz 006045502.td-b3lyp_6-31g+(d).inp 006045502.td-b3lyp_6-31g+(d).log.xz

006045502.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045502.td-b3lyp_6-31+g(d).gjf (generated)

006045502.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045502.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045502.mol 006045502.PUBCHEM 006045502.mol (via Jmol)
006045624.b3lyp_6-31g(d).inp

006045624.b3lyp_6-31g(d).qchem.inp (generated)

006045624.b3lyp_6-31g(d).gjf (generated)

006045624.b3lyp_6-31g(d).firefly.inp (generated)

006045624.b3lyp_6-31g(d).smash.inp (generated)

006045624.b3lyp_6-31g(d).nwchem.inp (generated) 006045624.b3lyp_6-31g(d).log.xz 006045624.td-b3lyp_6-31g+(d).inp 006045624.td-b3lyp_6-31g+(d).log.xz

006045624.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045624.td-b3lyp_6-31+g(d).gjf (generated)

006045624.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045624.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045624.mol 006045624.PUBCHEM 006045624.mol (via Jmol)
006045655.b3lyp_6-31g(d).inp

006045655.b3lyp_6-31g(d).qchem.inp (generated)

006045655.b3lyp_6-31g(d).gjf (generated)

006045655.b3lyp_6-31g(d).firefly.inp (generated)

006045655.b3lyp_6-31g(d).smash.inp (generated)

006045655.b3lyp_6-31g(d).nwchem.inp (generated) 006045655.b3lyp_6-31g(d).log.xz 006045655.td-b3lyp_6-31g+(d).inp 006045655.td-b3lyp_6-31g+(d).log.xz

006045655.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045655.td-b3lyp_6-31+g(d).gjf (generated)

006045655.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045655.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045655.mol 006045655.PUBCHEM 006045655.mol (via Jmol)
006045739.b3lyp_6-31g(d).inp

006045739.b3lyp_6-31g(d).qchem.inp (generated)

006045739.b3lyp_6-31g(d).gjf (generated)

006045739.b3lyp_6-31g(d).firefly.inp (generated)

006045739.b3lyp_6-31g(d).smash.inp (generated)

006045739.b3lyp_6-31g(d).nwchem.inp (generated) 006045739.b3lyp_6-31g(d).log.xz 006045739.td-b3lyp_6-31g+(d).inp 006045739.td-b3lyp_6-31g+(d).log.xz

006045739.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045739.td-b3lyp_6-31+g(d).gjf (generated)

006045739.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045739.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045739.mol 006045739.PUBCHEM 006045739.mol (via Jmol)
006045828.b3lyp_6-31g(d).inp

006045828.b3lyp_6-31g(d).qchem.inp (generated)

006045828.b3lyp_6-31g(d).gjf (generated)

006045828.b3lyp_6-31g(d).firefly.inp (generated)

006045828.b3lyp_6-31g(d).smash.inp (generated)

006045828.b3lyp_6-31g(d).nwchem.inp (generated) 006045828.b3lyp_6-31g(d).log.xz 006045828.mol 006045828.PUBCHEM 006045828.mol (via Jmol)
006045899.b3lyp_6-31g(d).inp

006045899.b3lyp_6-31g(d).qchem.inp (generated)

006045899.b3lyp_6-31g(d).gjf (generated)

006045899.b3lyp_6-31g(d).firefly.inp (generated)

006045899.b3lyp_6-31g(d).smash.inp (generated)

006045899.b3lyp_6-31g(d).nwchem.inp (generated) 006045899.b3lyp_6-31g(d).log.xz 006045899.td-b3lyp_6-31g+(d).inp 006045899.td-b3lyp_6-31g+(d).log.xz

006045899.td-b3lyp_6-31+g(d).qchem.inp (generated)

006045899.td-b3lyp_6-31+g(d).gjf (generated)

006045899.td-b3lyp_6-31+g(d).firefly.inp (generated)

006045899.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006045899.mol 006045899.PUBCHEM 006045899.mol (via Jmol)
006046003.b3lyp_6-31g(d).inp

006046003.b3lyp_6-31g(d).qchem.inp (generated)

006046003.b3lyp_6-31g(d).gjf (generated)

006046003.b3lyp_6-31g(d).firefly.inp (generated)

006046003.b3lyp_6-31g(d).smash.inp (generated)

006046003.b3lyp_6-31g(d).nwchem.inp (generated) 006046003.b3lyp_6-31g(d).log.xz 006046003.td-b3lyp_6-31g+(d).inp 006046003.td-b3lyp_6-31g+(d).log.xz

006046003.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046003.td-b3lyp_6-31+g(d).gjf (generated)

006046003.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046003.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046003.mol 006046003.PUBCHEM 006046003.mol (via Jmol)
006046123.b3lyp_6-31g(d).inp

006046123.b3lyp_6-31g(d).qchem.inp (generated)

006046123.b3lyp_6-31g(d).gjf (generated)

006046123.b3lyp_6-31g(d).firefly.inp (generated)

006046123.b3lyp_6-31g(d).smash.inp (generated)

006046123.b3lyp_6-31g(d).nwchem.inp (generated) 006046123.b3lyp_6-31g(d).log.xz 006046123.td-b3lyp_6-31g+(d).inp 006046123.td-b3lyp_6-31g+(d).log.xz

006046123.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046123.td-b3lyp_6-31+g(d).gjf (generated)

006046123.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046123.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046123.mol 006046123.PUBCHEM 006046123.mol (via Jmol)
006046194.b3lyp_6-31g(d).inp

006046194.b3lyp_6-31g(d).qchem.inp (generated)

006046194.b3lyp_6-31g(d).gjf (generated)

006046194.b3lyp_6-31g(d).firefly.inp (generated)

006046194.b3lyp_6-31g(d).smash.inp (generated)

006046194.b3lyp_6-31g(d).nwchem.inp (generated) 006046194.b3lyp_6-31g(d).log.xz 006046194.td-b3lyp_6-31g+(d).inp 006046194.td-b3lyp_6-31g+(d).log.xz

006046194.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046194.td-b3lyp_6-31+g(d).gjf (generated)

006046194.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046194.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046194.mol 006046194.PUBCHEM 006046194.mol (via Jmol)
006046345.b3lyp_6-31g(d).inp

006046345.b3lyp_6-31g(d).qchem.inp (generated)

006046345.b3lyp_6-31g(d).gjf (generated)

006046345.b3lyp_6-31g(d).firefly.inp (generated)

006046345.b3lyp_6-31g(d).smash.inp (generated)

006046345.b3lyp_6-31g(d).nwchem.inp (generated) 006046345.b3lyp_6-31g(d).log.xz 006046345.td-b3lyp_6-31g+(d).inp 006046345.td-b3lyp_6-31g+(d).log.xz

006046345.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046345.td-b3lyp_6-31+g(d).gjf (generated)

006046345.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046345.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046345.mol 006046345.PUBCHEM 006046345.mol (via Jmol)
006046371.b3lyp_6-31g(d).inp

006046371.b3lyp_6-31g(d).qchem.inp (generated)

006046371.b3lyp_6-31g(d).gjf (generated)

006046371.b3lyp_6-31g(d).firefly.inp (generated)

006046371.b3lyp_6-31g(d).smash.inp (generated)

006046371.b3lyp_6-31g(d).nwchem.inp (generated) 006046371.b3lyp_6-31g(d).log.xz 006046371.td-b3lyp_6-31g+(d).inp 006046371.td-b3lyp_6-31g+(d).log.xz

006046371.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046371.td-b3lyp_6-31+g(d).gjf (generated)

006046371.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046371.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046371.mol 006046371.PUBCHEM 006046371.mol (via Jmol)
006046421.b3lyp_6-31g(d).inp

006046421.b3lyp_6-31g(d).qchem.inp (generated)

006046421.b3lyp_6-31g(d).gjf (generated)

006046421.b3lyp_6-31g(d).firefly.inp (generated)

006046421.b3lyp_6-31g(d).smash.inp (generated)

006046421.b3lyp_6-31g(d).nwchem.inp (generated) 006046421.b3lyp_6-31g(d).log.xz 006046421.td-b3lyp_6-31g+(d).inp 006046421.td-b3lyp_6-31g+(d).log.xz

006046421.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046421.td-b3lyp_6-31+g(d).gjf (generated)

006046421.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046421.mol 006046421.PUBCHEM 006046421.mol (via Jmol)
006046532.b3lyp_6-31g(d).inp

006046532.b3lyp_6-31g(d).qchem.inp (generated)

006046532.b3lyp_6-31g(d).gjf (generated)

006046532.b3lyp_6-31g(d).firefly.inp (generated)

006046532.b3lyp_6-31g(d).smash.inp (generated)

006046532.b3lyp_6-31g(d).nwchem.inp (generated) 006046532.b3lyp_6-31g(d).log.xz 006046532.td-b3lyp_6-31g+(d).inp 006046532.td-b3lyp_6-31g+(d).log.xz

006046532.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046532.td-b3lyp_6-31+g(d).gjf (generated)

006046532.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046532.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046532.mol 006046532.PUBCHEM 006046532.mol (via Jmol)
006046563.b3lyp_6-31g(d).inp

006046563.b3lyp_6-31g(d).qchem.inp (generated)

006046563.b3lyp_6-31g(d).gjf (generated)

006046563.b3lyp_6-31g(d).firefly.inp (generated)

006046563.b3lyp_6-31g(d).smash.inp (generated)

006046563.b3lyp_6-31g(d).nwchem.inp (generated) 006046563.b3lyp_6-31g(d).log.xz 006046563.mol 006046563.PUBCHEM 006046563.mol (via Jmol)
006046593.b3lyp_6-31g(d).inp

006046593.b3lyp_6-31g(d).qchem.inp (generated)

006046593.b3lyp_6-31g(d).gjf (generated)

006046593.b3lyp_6-31g(d).firefly.inp (generated)

006046593.b3lyp_6-31g(d).smash.inp (generated)

006046593.b3lyp_6-31g(d).nwchem.inp (generated) 006046593.b3lyp_6-31g(d).log.xz 006046593.mol 006046593.PUBCHEM 006046593.mol (via Jmol)
006046825.b3lyp_6-31g(d).inp

006046825.b3lyp_6-31g(d).qchem.inp (generated)

006046825.b3lyp_6-31g(d).gjf (generated)

006046825.b3lyp_6-31g(d).firefly.inp (generated)

006046825.b3lyp_6-31g(d).smash.inp (generated)

006046825.b3lyp_6-31g(d).nwchem.inp (generated) 006046825.b3lyp_6-31g(d).log.xz 006046825.td-b3lyp_6-31g+(d).inp 006046825.td-b3lyp_6-31g+(d).log.xz

006046825.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046825.td-b3lyp_6-31+g(d).gjf (generated)

006046825.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046825.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046825.mol 006046825.PUBCHEM 006046825.mol (via Jmol)
006046941.b3lyp_6-31g(d).inp

006046941.b3lyp_6-31g(d).qchem.inp (generated)

006046941.b3lyp_6-31g(d).gjf (generated)

006046941.b3lyp_6-31g(d).firefly.inp (generated)

006046941.b3lyp_6-31g(d).smash.inp (generated)

006046941.b3lyp_6-31g(d).nwchem.inp (generated) 006046941.b3lyp_6-31g(d).log.xz 006046941.td-b3lyp_6-31g+(d).inp 006046941.td-b3lyp_6-31g+(d).log.xz

006046941.td-b3lyp_6-31+g(d).qchem.inp (generated)

006046941.td-b3lyp_6-31+g(d).gjf (generated)

006046941.td-b3lyp_6-31+g(d).firefly.inp (generated)

006046941.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006046941.mol 006046941.PUBCHEM 006046941.mol (via Jmol)
006047084.b3lyp_6-31g(d).inp

006047084.b3lyp_6-31g(d).qchem.inp (generated)

006047084.b3lyp_6-31g(d).gjf (generated)

006047084.b3lyp_6-31g(d).firefly.inp (generated)

006047084.b3lyp_6-31g(d).smash.inp (generated)

006047084.b3lyp_6-31g(d).nwchem.inp (generated) 006047084.b3lyp_6-31g(d).log.xz 006047084.td-b3lyp_6-31g+(d).inp 006047084.td-b3lyp_6-31g+(d).log.xz

006047084.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047084.td-b3lyp_6-31+g(d).gjf (generated)

006047084.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047084.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047084.mol 006047084.PUBCHEM 006047084.mol (via Jmol)
006047199.b3lyp_6-31g(d).inp

006047199.b3lyp_6-31g(d).qchem.inp (generated)

006047199.b3lyp_6-31g(d).gjf (generated)

006047199.b3lyp_6-31g(d).firefly.inp (generated)

006047199.b3lyp_6-31g(d).smash.inp (generated)

006047199.b3lyp_6-31g(d).nwchem.inp (generated) 006047199.b3lyp_6-31g(d).log.xz 006047199.td-b3lyp_6-31g+(d).inp 006047199.td-b3lyp_6-31g+(d).log.xz

006047199.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047199.td-b3lyp_6-31+g(d).gjf (generated)

006047199.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047199.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047199.mol 006047199.PUBCHEM 006047199.mol (via Jmol)
006047232.b3lyp_6-31g(d).inp

006047232.b3lyp_6-31g(d).qchem.inp (generated)

006047232.b3lyp_6-31g(d).gjf (generated)

006047232.b3lyp_6-31g(d).firefly.inp (generated)

006047232.b3lyp_6-31g(d).smash.inp (generated)

006047232.b3lyp_6-31g(d).nwchem.inp (generated) 006047232.b3lyp_6-31g(d).log.xz 006047232.td-b3lyp_6-31g+(d).inp 006047232.td-b3lyp_6-31g+(d).log.xz

006047232.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047232.td-b3lyp_6-31+g(d).gjf (generated)

006047232.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047232.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047232.mol 006047232.PUBCHEM 006047232.mol (via Jmol)
006047247.b3lyp_6-31g(d).inp

006047247.b3lyp_6-31g(d).qchem.inp (generated)

006047247.b3lyp_6-31g(d).gjf (generated)

006047247.b3lyp_6-31g(d).firefly.inp (generated)

006047247.b3lyp_6-31g(d).smash.inp (generated)

006047247.b3lyp_6-31g(d).nwchem.inp (generated) 006047247.b3lyp_6-31g(d).log.xz 006047247.td-b3lyp_6-31g+(d).inp 006047247.td-b3lyp_6-31g+(d).log.xz

006047247.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047247.td-b3lyp_6-31+g(d).gjf (generated)

006047247.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047247.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047247.mol 006047247.PUBCHEM 006047247.mol (via Jmol)
006047274.b3lyp_6-31g(d).inp

006047274.b3lyp_6-31g(d).qchem.inp (generated)

006047274.b3lyp_6-31g(d).gjf (generated)

006047274.b3lyp_6-31g(d).firefly.inp (generated)

006047274.b3lyp_6-31g(d).smash.inp (generated)

006047274.b3lyp_6-31g(d).nwchem.inp (generated) 006047274.b3lyp_6-31g(d).log.xz 006047274.td-b3lyp_6-31g+(d).inp 006047274.td-b3lyp_6-31g+(d).log.xz

006047274.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047274.td-b3lyp_6-31+g(d).gjf (generated)

006047274.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047274.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047274.mol 006047274.PUBCHEM 006047274.mol (via Jmol)
006047303.b3lyp_6-31g(d).inp

006047303.b3lyp_6-31g(d).qchem.inp (generated)

006047303.b3lyp_6-31g(d).gjf (generated)

006047303.b3lyp_6-31g(d).firefly.inp (generated)

006047303.b3lyp_6-31g(d).smash.inp (generated)

006047303.b3lyp_6-31g(d).nwchem.inp (generated) 006047303.b3lyp_6-31g(d).log.xz 006047303.td-b3lyp_6-31g+(d).inp 006047303.td-b3lyp_6-31g+(d).log.xz

006047303.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047303.td-b3lyp_6-31+g(d).gjf (generated)

006047303.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047303.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047303.mol 006047303.PUBCHEM 006047303.mol (via Jmol)
006047487.b3lyp_6-31g(d).inp

006047487.b3lyp_6-31g(d).qchem.inp (generated)

006047487.b3lyp_6-31g(d).gjf (generated)

006047487.b3lyp_6-31g(d).firefly.inp (generated)

006047487.b3lyp_6-31g(d).smash.inp (generated)

006047487.b3lyp_6-31g(d).nwchem.inp (generated) 006047487.b3lyp_6-31g(d).log.xz 006047487.td-b3lyp_6-31g+(d).inp 006047487.td-b3lyp_6-31g+(d).log.xz

006047487.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047487.td-b3lyp_6-31+g(d).gjf (generated)

006047487.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047487.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047487.mol 006047487.PUBCHEM 006047487.mol (via Jmol)
006047558.b3lyp_6-31g(d).inp

006047558.b3lyp_6-31g(d).qchem.inp (generated)

006047558.b3lyp_6-31g(d).gjf (generated)

006047558.b3lyp_6-31g(d).firefly.inp (generated)

006047558.b3lyp_6-31g(d).smash.inp (generated)

006047558.b3lyp_6-31g(d).nwchem.inp (generated) 006047558.b3lyp_6-31g(d).log.xz 006047558.td-b3lyp_6-31g+(d).inp 006047558.td-b3lyp_6-31g+(d).log.xz

006047558.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047558.td-b3lyp_6-31+g(d).gjf (generated)

006047558.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047558.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047558.mol 006047558.PUBCHEM 006047558.mol (via Jmol)
006047596.b3lyp_6-31g(d).inp

006047596.b3lyp_6-31g(d).qchem.inp (generated)

006047596.b3lyp_6-31g(d).gjf (generated)

006047596.b3lyp_6-31g(d).firefly.inp (generated)

006047596.b3lyp_6-31g(d).smash.inp (generated)

006047596.b3lyp_6-31g(d).nwchem.inp (generated) 006047596.b3lyp_6-31g(d).log.xz 006047596.td-b3lyp_6-31g+(d).inp 006047596.td-b3lyp_6-31g+(d).log.xz

006047596.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047596.td-b3lyp_6-31+g(d).gjf (generated)

006047596.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047596.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047596.mol 006047596.PUBCHEM 006047596.mol (via Jmol)
006047681.b3lyp_6-31g(d).inp

006047681.b3lyp_6-31g(d).qchem.inp (generated)

006047681.b3lyp_6-31g(d).gjf (generated)

006047681.b3lyp_6-31g(d).firefly.inp (generated)

006047681.b3lyp_6-31g(d).smash.inp (generated)

006047681.b3lyp_6-31g(d).nwchem.inp (generated) 006047681.b3lyp_6-31g(d).log.xz 006047681.td-b3lyp_6-31g+(d).inp 006047681.td-b3lyp_6-31g+(d).log.xz

006047681.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047681.td-b3lyp_6-31+g(d).gjf (generated)

006047681.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047681.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047681.mol 006047681.PUBCHEM 006047681.mol (via Jmol)
006047686.b3lyp_6-31g(d).inp

006047686.b3lyp_6-31g(d).qchem.inp (generated)

006047686.b3lyp_6-31g(d).gjf (generated)

006047686.b3lyp_6-31g(d).firefly.inp (generated)

006047686.b3lyp_6-31g(d).smash.inp (generated)

006047686.b3lyp_6-31g(d).nwchem.inp (generated) 006047686.b3lyp_6-31g(d).log.xz 006047686.td-b3lyp_6-31g+(d).inp 006047686.td-b3lyp_6-31g+(d).log.xz

006047686.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047686.td-b3lyp_6-31+g(d).gjf (generated)

006047686.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047686.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047686.mol 006047686.PUBCHEM 006047686.mol (via Jmol)
006047984.b3lyp_6-31g(d).inp

006047984.b3lyp_6-31g(d).qchem.inp (generated)

006047984.b3lyp_6-31g(d).gjf (generated)

006047984.b3lyp_6-31g(d).firefly.inp (generated)

006047984.b3lyp_6-31g(d).smash.inp (generated)

006047984.b3lyp_6-31g(d).nwchem.inp (generated) 006047984.b3lyp_6-31g(d).log.xz 006047984.td-b3lyp_6-31g+(d).inp 006047984.td-b3lyp_6-31g+(d).log.xz

006047984.td-b3lyp_6-31+g(d).qchem.inp (generated)

006047984.td-b3lyp_6-31+g(d).gjf (generated)

006047984.td-b3lyp_6-31+g(d).firefly.inp (generated)

006047984.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006047984.mol 006047984.PUBCHEM 006047984.mol (via Jmol)
006048023.b3lyp_6-31g(d).inp

006048023.b3lyp_6-31g(d).qchem.inp (generated)

006048023.b3lyp_6-31g(d).gjf (generated)

006048023.b3lyp_6-31g(d).firefly.inp (generated)

006048023.b3lyp_6-31g(d).smash.inp (generated)

006048023.b3lyp_6-31g(d).nwchem.inp (generated) 006048023.b3lyp_6-31g(d).log.xz 006048023.td-b3lyp_6-31g+(d).inp 006048023.td-b3lyp_6-31g+(d).log.xz

006048023.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048023.td-b3lyp_6-31+g(d).gjf (generated)

006048023.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048023.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048023.mol 006048023.PUBCHEM 006048023.mol (via Jmol)
006048098.b3lyp_6-31g(d).inp

006048098.b3lyp_6-31g(d).qchem.inp (generated)

006048098.b3lyp_6-31g(d).gjf (generated)

006048098.b3lyp_6-31g(d).firefly.inp (generated)

006048098.b3lyp_6-31g(d).smash.inp (generated)

006048098.b3lyp_6-31g(d).nwchem.inp (generated) 006048098.b3lyp_6-31g(d).log.xz 006048098.td-b3lyp_6-31g+(d).inp 006048098.td-b3lyp_6-31g+(d).log.xz

006048098.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048098.td-b3lyp_6-31+g(d).gjf (generated)

006048098.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048098.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048098.mol 006048098.PUBCHEM 006048098.mol (via Jmol)
006048133.b3lyp_6-31g(d).inp

006048133.b3lyp_6-31g(d).qchem.inp (generated)

006048133.b3lyp_6-31g(d).gjf (generated)

006048133.b3lyp_6-31g(d).firefly.inp (generated)

006048133.b3lyp_6-31g(d).smash.inp (generated)

006048133.b3lyp_6-31g(d).nwchem.inp (generated) 006048133.b3lyp_6-31g(d).log.xz 006048133.td-b3lyp_6-31g+(d).inp 006048133.td-b3lyp_6-31g+(d).log.xz

006048133.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048133.td-b3lyp_6-31+g(d).gjf (generated)

006048133.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048133.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048133.mol 006048133.PUBCHEM 006048133.mol (via Jmol)
006048191.b3lyp_6-31g(d).inp

006048191.b3lyp_6-31g(d).qchem.inp (generated)

006048191.b3lyp_6-31g(d).gjf (generated)

006048191.b3lyp_6-31g(d).firefly.inp (generated)

006048191.b3lyp_6-31g(d).smash.inp (generated)

006048191.b3lyp_6-31g(d).nwchem.inp (generated) 006048191.b3lyp_6-31g(d).log.xz 006048191.mol 006048191.PUBCHEM 006048191.mol (via Jmol)
006048217.b3lyp_6-31g(d).inp

006048217.b3lyp_6-31g(d).qchem.inp (generated)

006048217.b3lyp_6-31g(d).gjf (generated)

006048217.b3lyp_6-31g(d).firefly.inp (generated)

006048217.b3lyp_6-31g(d).smash.inp (generated)

006048217.b3lyp_6-31g(d).nwchem.inp (generated) 006048217.b3lyp_6-31g(d).log.xz 006048217.td-b3lyp_6-31g+(d).inp 006048217.td-b3lyp_6-31g+(d).log.xz

006048217.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048217.td-b3lyp_6-31+g(d).gjf (generated)

006048217.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048217.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048217.mol 006048217.PUBCHEM 006048217.mol (via Jmol)
006048261.b3lyp_6-31g(d).inp

006048261.b3lyp_6-31g(d).qchem.inp (generated)

006048261.b3lyp_6-31g(d).gjf (generated)

006048261.b3lyp_6-31g(d).firefly.inp (generated)

006048261.b3lyp_6-31g(d).smash.inp (generated)

006048261.b3lyp_6-31g(d).nwchem.inp (generated) 006048261.b3lyp_6-31g(d).log.xz 006048261.td-b3lyp_6-31g+(d).inp 006048261.td-b3lyp_6-31g+(d).log.xz

006048261.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048261.td-b3lyp_6-31+g(d).gjf (generated)

006048261.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048261.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048261.mol 006048261.PUBCHEM 006048261.mol (via Jmol)
006048264.b3lyp_6-31g(d).inp

006048264.b3lyp_6-31g(d).qchem.inp (generated)

006048264.b3lyp_6-31g(d).gjf (generated)

006048264.b3lyp_6-31g(d).firefly.inp (generated)

006048264.b3lyp_6-31g(d).smash.inp (generated)

006048264.b3lyp_6-31g(d).nwchem.inp (generated) 006048264.b3lyp_6-31g(d).log.xz 006048264.td-b3lyp_6-31g+(d).inp 006048264.td-b3lyp_6-31g+(d).log.xz

006048264.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048264.td-b3lyp_6-31+g(d).gjf (generated)

006048264.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048264.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048264.mol 006048264.PUBCHEM 006048264.mol (via Jmol)
006048416.b3lyp_6-31g(d).inp

006048416.b3lyp_6-31g(d).qchem.inp (generated)

006048416.b3lyp_6-31g(d).gjf (generated)

006048416.b3lyp_6-31g(d).firefly.inp (generated)

006048416.b3lyp_6-31g(d).smash.inp (generated)

006048416.b3lyp_6-31g(d).nwchem.inp (generated) 006048416.b3lyp_6-31g(d).log.xz 006048416.td-b3lyp_6-31g+(d).inp 006048416.td-b3lyp_6-31g+(d).log.xz

006048416.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048416.td-b3lyp_6-31+g(d).gjf (generated)

006048416.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048416.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048416.mol 006048416.PUBCHEM 006048416.mol (via Jmol)
006048421.b3lyp_6-31g(d).inp

006048421.b3lyp_6-31g(d).qchem.inp (generated)

006048421.b3lyp_6-31g(d).gjf (generated)

006048421.b3lyp_6-31g(d).firefly.inp (generated)

006048421.b3lyp_6-31g(d).smash.inp (generated)

006048421.b3lyp_6-31g(d).nwchem.inp (generated) 006048421.b3lyp_6-31g(d).log.xz 006048421.td-b3lyp_6-31g+(d).inp 006048421.td-b3lyp_6-31g+(d).log.xz

006048421.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048421.td-b3lyp_6-31+g(d).gjf (generated)

006048421.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048421.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048421.mol 006048421.PUBCHEM 006048421.mol (via Jmol)
006048481.b3lyp_6-31g(d).inp

006048481.b3lyp_6-31g(d).qchem.inp (generated)

006048481.b3lyp_6-31g(d).gjf (generated)

006048481.b3lyp_6-31g(d).firefly.inp (generated)

006048481.b3lyp_6-31g(d).smash.inp (generated)

006048481.b3lyp_6-31g(d).nwchem.inp (generated) 006048481.b3lyp_6-31g(d).log.xz 006048481.td-b3lyp_6-31g+(d).inp 006048481.td-b3lyp_6-31g+(d).log.xz

006048481.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048481.td-b3lyp_6-31+g(d).gjf (generated)

006048481.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048481.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048481.mol 006048481.PUBCHEM 006048481.mol (via Jmol)
006048519.b3lyp_6-31g(d).inp

006048519.b3lyp_6-31g(d).qchem.inp (generated)

006048519.b3lyp_6-31g(d).gjf (generated)

006048519.b3lyp_6-31g(d).firefly.inp (generated)

006048519.b3lyp_6-31g(d).smash.inp (generated)

006048519.b3lyp_6-31g(d).nwchem.inp (generated) 006048519.b3lyp_6-31g(d).log.xz 006048519.td-b3lyp_6-31g+(d).inp 006048519.td-b3lyp_6-31g+(d).log.xz

006048519.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048519.td-b3lyp_6-31+g(d).gjf (generated)

006048519.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048519.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048519.mol 006048519.PUBCHEM 006048519.mol (via Jmol)
006048663.b3lyp_6-31g(d).inp

006048663.b3lyp_6-31g(d).qchem.inp (generated)

006048663.b3lyp_6-31g(d).gjf (generated)

006048663.b3lyp_6-31g(d).firefly.inp (generated)

006048663.b3lyp_6-31g(d).smash.inp (generated)

006048663.b3lyp_6-31g(d).nwchem.inp (generated) 006048663.b3lyp_6-31g(d).log.xz 006048663.td-b3lyp_6-31g+(d).inp 006048663.td-b3lyp_6-31g+(d).log.xz

006048663.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048663.td-b3lyp_6-31+g(d).gjf (generated)

006048663.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048663.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048663.mol 006048663.PUBCHEM 006048663.mol (via Jmol)
006048763.b3lyp_6-31g(d).inp

006048763.b3lyp_6-31g(d).qchem.inp (generated)

006048763.b3lyp_6-31g(d).gjf (generated)

006048763.b3lyp_6-31g(d).firefly.inp (generated)

006048763.b3lyp_6-31g(d).smash.inp (generated)

006048763.b3lyp_6-31g(d).nwchem.inp (generated) 006048763.b3lyp_6-31g(d).log.xz 006048763.td-b3lyp_6-31g+(d).inp 006048763.td-b3lyp_6-31g+(d).log.xz

006048763.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048763.td-b3lyp_6-31+g(d).gjf (generated)

006048763.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048763.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048763.mol 006048763.PUBCHEM 006048763.mol (via Jmol)
006048933.b3lyp_6-31g(d).inp

006048933.b3lyp_6-31g(d).qchem.inp (generated)

006048933.b3lyp_6-31g(d).gjf (generated)

006048933.b3lyp_6-31g(d).firefly.inp (generated)

006048933.b3lyp_6-31g(d).smash.inp (generated)

006048933.b3lyp_6-31g(d).nwchem.inp (generated) 006048933.b3lyp_6-31g(d).log.xz 006048933.mol 006048933.PUBCHEM 006048933.mol (via Jmol)
006048947.b3lyp_6-31g(d).inp

006048947.b3lyp_6-31g(d).qchem.inp (generated)

006048947.b3lyp_6-31g(d).gjf (generated)

006048947.b3lyp_6-31g(d).firefly.inp (generated)

006048947.b3lyp_6-31g(d).smash.inp (generated)

006048947.b3lyp_6-31g(d).nwchem.inp (generated) 006048947.b3lyp_6-31g(d).log.xz 006048947.td-b3lyp_6-31g+(d).inp 006048947.td-b3lyp_6-31g+(d).log.xz

006048947.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048947.td-b3lyp_6-31+g(d).gjf (generated)

006048947.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048947.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048947.mol 006048947.PUBCHEM 006048947.mol (via Jmol)
006048956.b3lyp_6-31g(d).inp

006048956.b3lyp_6-31g(d).qchem.inp (generated)

006048956.b3lyp_6-31g(d).gjf (generated)

006048956.b3lyp_6-31g(d).firefly.inp (generated)

006048956.b3lyp_6-31g(d).smash.inp (generated)

006048956.b3lyp_6-31g(d).nwchem.inp (generated) 006048956.b3lyp_6-31g(d).log.xz 006048956.td-b3lyp_6-31g+(d).inp 006048956.td-b3lyp_6-31g+(d).log.xz

006048956.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048956.td-b3lyp_6-31+g(d).gjf (generated)

006048956.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048956.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048956.mol 006048956.PUBCHEM 006048956.mol (via Jmol)
006048961.b3lyp_6-31g(d).inp

006048961.b3lyp_6-31g(d).qchem.inp (generated)

006048961.b3lyp_6-31g(d).gjf (generated)

006048961.b3lyp_6-31g(d).firefly.inp (generated)

006048961.b3lyp_6-31g(d).smash.inp (generated)

006048961.b3lyp_6-31g(d).nwchem.inp (generated) 006048961.b3lyp_6-31g(d).log.xz 006048961.td-b3lyp_6-31g+(d).inp 006048961.td-b3lyp_6-31g+(d).log.xz

006048961.td-b3lyp_6-31+g(d).qchem.inp (generated)

006048961.td-b3lyp_6-31+g(d).gjf (generated)

006048961.td-b3lyp_6-31+g(d).firefly.inp (generated)

006048961.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006048961.mol 006048961.PUBCHEM 006048961.mol (via Jmol)
006049015.b3lyp_6-31g(d).inp

006049015.b3lyp_6-31g(d).qchem.inp (generated)

006049015.b3lyp_6-31g(d).gjf (generated)

006049015.b3lyp_6-31g(d).firefly.inp (generated)

006049015.b3lyp_6-31g(d).smash.inp (generated)

006049015.b3lyp_6-31g(d).nwchem.inp (generated) 006049015.b3lyp_6-31g(d).log.xz 006049015.td-b3lyp_6-31g+(d).inp 006049015.td-b3lyp_6-31g+(d).log.xz

006049015.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049015.td-b3lyp_6-31+g(d).gjf (generated)

006049015.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049015.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049015.mol 006049015.PUBCHEM 006049015.mol (via Jmol)
006049019.b3lyp_6-31g(d).inp

006049019.b3lyp_6-31g(d).qchem.inp (generated)

006049019.b3lyp_6-31g(d).gjf (generated)

006049019.b3lyp_6-31g(d).firefly.inp (generated)

006049019.b3lyp_6-31g(d).smash.inp (generated)

006049019.b3lyp_6-31g(d).nwchem.inp (generated) 006049019.b3lyp_6-31g(d).log.xz 006049019.td-b3lyp_6-31g+(d).inp 006049019.td-b3lyp_6-31g+(d).log.xz

006049019.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049019.td-b3lyp_6-31+g(d).gjf (generated)

006049019.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049019.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049019.mol 006049019.PUBCHEM 006049019.mol (via Jmol)
006049037.b3lyp_6-31g(d).inp

006049037.b3lyp_6-31g(d).qchem.inp (generated)

006049037.b3lyp_6-31g(d).gjf (generated)

006049037.b3lyp_6-31g(d).firefly.inp (generated)

006049037.b3lyp_6-31g(d).smash.inp (generated)

006049037.b3lyp_6-31g(d).nwchem.inp (generated) 006049037.b3lyp_6-31g(d).log.xz 006049037.td-b3lyp_6-31g+(d).inp 006049037.td-b3lyp_6-31g+(d).log.xz

006049037.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049037.td-b3lyp_6-31+g(d).gjf (generated)

006049037.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049037.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049037.mol 006049037.PUBCHEM 006049037.mol (via Jmol)
006049051.b3lyp_6-31g(d).inp

006049051.b3lyp_6-31g(d).qchem.inp (generated)

006049051.b3lyp_6-31g(d).gjf (generated)

006049051.b3lyp_6-31g(d).firefly.inp (generated)

006049051.b3lyp_6-31g(d).smash.inp (generated)

006049051.b3lyp_6-31g(d).nwchem.inp (generated) 006049051.b3lyp_6-31g(d).log.xz 006049051.mol 006049051.PUBCHEM 006049051.mol (via Jmol)
006049159.b3lyp_6-31g(d).inp

006049159.b3lyp_6-31g(d).qchem.inp (generated)

006049159.b3lyp_6-31g(d).gjf (generated)

006049159.b3lyp_6-31g(d).firefly.inp (generated)

006049159.b3lyp_6-31g(d).smash.inp (generated)

006049159.b3lyp_6-31g(d).nwchem.inp (generated) 006049159.b3lyp_6-31g(d).log.xz 006049159.td-b3lyp_6-31g+(d).inp 006049159.td-b3lyp_6-31g+(d).log.xz

006049159.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049159.td-b3lyp_6-31+g(d).gjf (generated)

006049159.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049159.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049159.mol 006049159.PUBCHEM 006049159.mol (via Jmol)
006049168.b3lyp_6-31g(d).inp

006049168.b3lyp_6-31g(d).qchem.inp (generated)

006049168.b3lyp_6-31g(d).gjf (generated)

006049168.b3lyp_6-31g(d).firefly.inp (generated)

006049168.b3lyp_6-31g(d).smash.inp (generated)

006049168.b3lyp_6-31g(d).nwchem.inp (generated) 006049168.b3lyp_6-31g(d).log.xz 006049168.mol 006049168.PUBCHEM 006049168.mol (via Jmol)
006049169.b3lyp_6-31g(d).inp

006049169.b3lyp_6-31g(d).qchem.inp (generated)

006049169.b3lyp_6-31g(d).gjf (generated)

006049169.b3lyp_6-31g(d).firefly.inp (generated)

006049169.b3lyp_6-31g(d).smash.inp (generated)

006049169.b3lyp_6-31g(d).nwchem.inp (generated) 006049169.b3lyp_6-31g(d).log.xz 006049169.td-b3lyp_6-31g+(d).inp 006049169.td-b3lyp_6-31g+(d).log.xz

006049169.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049169.td-b3lyp_6-31+g(d).gjf (generated)

006049169.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049169.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049169.mol 006049169.PUBCHEM 006049169.mol (via Jmol)
006049172.b3lyp_6-31g(d).inp

006049172.b3lyp_6-31g(d).qchem.inp (generated)

006049172.b3lyp_6-31g(d).gjf (generated)

006049172.b3lyp_6-31g(d).firefly.inp (generated)

006049172.b3lyp_6-31g(d).smash.inp (generated)

006049172.b3lyp_6-31g(d).nwchem.inp (generated) 006049172.b3lyp_6-31g(d).log.xz 006049172.td-b3lyp_6-31g+(d).inp 006049172.td-b3lyp_6-31g+(d).log.xz

006049172.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049172.td-b3lyp_6-31+g(d).gjf (generated)

006049172.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049172.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049172.mol 006049172.PUBCHEM 006049172.mol (via Jmol)
006049174.b3lyp_6-31g(d).inp

006049174.b3lyp_6-31g(d).qchem.inp (generated)

006049174.b3lyp_6-31g(d).gjf (generated)

006049174.b3lyp_6-31g(d).firefly.inp (generated)

006049174.b3lyp_6-31g(d).smash.inp (generated)

006049174.b3lyp_6-31g(d).nwchem.inp (generated) 006049174.b3lyp_6-31g(d).log.xz 006049174.td-b3lyp_6-31g+(d).inp 006049174.td-b3lyp_6-31g+(d).log.xz

006049174.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049174.td-b3lyp_6-31+g(d).gjf (generated)

006049174.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049174.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049174.mol 006049174.PUBCHEM 006049174.mol (via Jmol)
006049184.b3lyp_6-31g(d).inp

006049184.b3lyp_6-31g(d).qchem.inp (generated)

006049184.b3lyp_6-31g(d).gjf (generated)

006049184.b3lyp_6-31g(d).firefly.inp (generated)

006049184.b3lyp_6-31g(d).smash.inp (generated)

006049184.b3lyp_6-31g(d).nwchem.inp (generated) 006049184.b3lyp_6-31g(d).log.xz 006049184.td-b3lyp_6-31g+(d).inp 006049184.td-b3lyp_6-31g+(d).log.xz

006049184.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049184.td-b3lyp_6-31+g(d).gjf (generated)

006049184.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049184.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049184.mol 006049184.PUBCHEM 006049184.mol (via Jmol)
006049269.b3lyp_6-31g(d).inp

006049269.b3lyp_6-31g(d).qchem.inp (generated)

006049269.b3lyp_6-31g(d).gjf (generated)

006049269.b3lyp_6-31g(d).firefly.inp (generated)

006049269.b3lyp_6-31g(d).smash.inp (generated)

006049269.b3lyp_6-31g(d).nwchem.inp (generated) 006049269.b3lyp_6-31g(d).log.xz 006049269.td-b3lyp_6-31g+(d).inp 006049269.td-b3lyp_6-31g+(d).log.xz

006049269.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049269.td-b3lyp_6-31+g(d).gjf (generated)

006049269.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049269.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049269.mol 006049269.PUBCHEM 006049269.mol (via Jmol)
006049384.b3lyp_6-31g(d).inp

006049384.b3lyp_6-31g(d).qchem.inp (generated)

006049384.b3lyp_6-31g(d).gjf (generated)

006049384.b3lyp_6-31g(d).firefly.inp (generated)

006049384.b3lyp_6-31g(d).smash.inp (generated)

006049384.b3lyp_6-31g(d).nwchem.inp (generated) 006049384.b3lyp_6-31g(d).log.xz 006049384.td-b3lyp_6-31g+(d).inp 006049384.td-b3lyp_6-31g+(d).log.xz

006049384.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049384.td-b3lyp_6-31+g(d).gjf (generated)

006049384.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049384.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049384.mol 006049384.PUBCHEM 006049384.mol (via Jmol)
006049437.b3lyp_6-31g(d).inp

006049437.b3lyp_6-31g(d).qchem.inp (generated)

006049437.b3lyp_6-31g(d).gjf (generated)

006049437.b3lyp_6-31g(d).firefly.inp (generated)

006049437.b3lyp_6-31g(d).smash.inp (generated)

006049437.b3lyp_6-31g(d).nwchem.inp (generated) 006049437.b3lyp_6-31g(d).log.xz 006049437.td-b3lyp_6-31g+(d).inp 006049437.td-b3lyp_6-31g+(d).log.xz

006049437.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049437.td-b3lyp_6-31+g(d).gjf (generated)

006049437.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049437.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049437.mol 006049437.PUBCHEM 006049437.mol (via Jmol)
006049592.b3lyp_6-31g(d).inp

006049592.b3lyp_6-31g(d).qchem.inp (generated)

006049592.b3lyp_6-31g(d).gjf (generated)

006049592.b3lyp_6-31g(d).firefly.inp (generated)

006049592.b3lyp_6-31g(d).smash.inp (generated)

006049592.b3lyp_6-31g(d).nwchem.inp (generated) 006049592.b3lyp_6-31g(d).log.xz 006049592.td-b3lyp_6-31g+(d).inp 006049592.td-b3lyp_6-31g+(d).log.xz

006049592.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049592.td-b3lyp_6-31+g(d).gjf (generated)

006049592.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049592.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049592.mol 006049592.PUBCHEM 006049592.mol (via Jmol)
006049683.b3lyp_6-31g(d).inp

006049683.b3lyp_6-31g(d).qchem.inp (generated)

006049683.b3lyp_6-31g(d).gjf (generated)

006049683.b3lyp_6-31g(d).firefly.inp (generated)

006049683.b3lyp_6-31g(d).smash.inp (generated)

006049683.b3lyp_6-31g(d).nwchem.inp (generated) 006049683.b3lyp_6-31g(d).log.xz 006049683.td-b3lyp_6-31g+(d).inp 006049683.td-b3lyp_6-31g+(d).log.xz

006049683.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049683.td-b3lyp_6-31+g(d).gjf (generated)

006049683.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049683.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049683.mol 006049683.PUBCHEM 006049683.mol (via Jmol)
006049816.b3lyp_6-31g(d).inp

006049816.b3lyp_6-31g(d).qchem.inp (generated)

006049816.b3lyp_6-31g(d).gjf (generated)

006049816.b3lyp_6-31g(d).firefly.inp (generated)

006049816.b3lyp_6-31g(d).smash.inp (generated)

006049816.b3lyp_6-31g(d).nwchem.inp (generated) 006049816.b3lyp_6-31g(d).log.xz 006049816.mol 006049816.PUBCHEM 006049816.mol (via Jmol)
006049818.b3lyp_6-31g(d).inp

006049818.b3lyp_6-31g(d).qchem.inp (generated)

006049818.b3lyp_6-31g(d).gjf (generated)

006049818.b3lyp_6-31g(d).firefly.inp (generated)

006049818.b3lyp_6-31g(d).smash.inp (generated)

006049818.b3lyp_6-31g(d).nwchem.inp (generated) 006049818.b3lyp_6-31g(d).log.xz 006049818.td-b3lyp_6-31g+(d).inp 006049818.td-b3lyp_6-31g+(d).log.xz

006049818.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049818.td-b3lyp_6-31+g(d).gjf (generated)

006049818.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049818.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049818.mol 006049818.PUBCHEM 006049818.mol (via Jmol)
006049837.b3lyp_6-31g(d).inp

006049837.b3lyp_6-31g(d).qchem.inp (generated)

006049837.b3lyp_6-31g(d).gjf (generated)

006049837.b3lyp_6-31g(d).firefly.inp (generated)

006049837.b3lyp_6-31g(d).smash.inp (generated)

006049837.b3lyp_6-31g(d).nwchem.inp (generated) 006049837.b3lyp_6-31g(d).log.xz 006049837.mol 006049837.PUBCHEM 006049837.mol (via Jmol)
006049852.b3lyp_6-31g(d).inp

006049852.b3lyp_6-31g(d).qchem.inp (generated)

006049852.b3lyp_6-31g(d).gjf (generated)

006049852.b3lyp_6-31g(d).firefly.inp (generated)

006049852.b3lyp_6-31g(d).smash.inp (generated)

006049852.b3lyp_6-31g(d).nwchem.inp (generated) 006049852.b3lyp_6-31g(d).log.xz 006049852.td-b3lyp_6-31g+(d).inp 006049852.td-b3lyp_6-31g+(d).log.xz

006049852.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049852.td-b3lyp_6-31+g(d).gjf (generated)

006049852.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049852.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049852.mol 006049852.PUBCHEM 006049852.mol (via Jmol)
006049860.b3lyp_6-31g(d).inp

006049860.b3lyp_6-31g(d).qchem.inp (generated)

006049860.b3lyp_6-31g(d).gjf (generated)

006049860.b3lyp_6-31g(d).firefly.inp (generated)

006049860.b3lyp_6-31g(d).smash.inp (generated)

006049860.b3lyp_6-31g(d).nwchem.inp (generated) 006049860.b3lyp_6-31g(d).log.xz 006049860.td-b3lyp_6-31g+(d).inp 006049860.td-b3lyp_6-31g+(d).log.xz

006049860.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049860.td-b3lyp_6-31+g(d).gjf (generated)

006049860.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049860.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049860.mol 006049860.PUBCHEM 006049860.mol (via Jmol)
006049887.b3lyp_6-31g(d).inp

006049887.b3lyp_6-31g(d).qchem.inp (generated)

006049887.b3lyp_6-31g(d).gjf (generated)

006049887.b3lyp_6-31g(d).firefly.inp (generated)

006049887.b3lyp_6-31g(d).smash.inp (generated)

006049887.b3lyp_6-31g(d).nwchem.inp (generated) 006049887.b3lyp_6-31g(d).log.xz 006049887.td-b3lyp_6-31g+(d).inp 006049887.td-b3lyp_6-31g+(d).log.xz

006049887.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049887.td-b3lyp_6-31+g(d).gjf (generated)

006049887.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049887.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049887.mol 006049887.PUBCHEM 006049887.mol (via Jmol)
006049960.b3lyp_6-31g(d).inp

006049960.b3lyp_6-31g(d).qchem.inp (generated)

006049960.b3lyp_6-31g(d).gjf (generated)

006049960.b3lyp_6-31g(d).firefly.inp (generated)

006049960.b3lyp_6-31g(d).smash.inp (generated)

006049960.b3lyp_6-31g(d).nwchem.inp (generated) 006049960.b3lyp_6-31g(d).log.xz 006049960.td-b3lyp_6-31g+(d).inp 006049960.td-b3lyp_6-31g+(d).log.xz

006049960.td-b3lyp_6-31+g(d).qchem.inp (generated)

006049960.td-b3lyp_6-31+g(d).gjf (generated)

006049960.td-b3lyp_6-31+g(d).firefly.inp (generated)

006049960.td-b3lyp_6-31+g(d).nwchem.inp (generated) 006049960.mol 006049960.PUBCHEM 006049960.mol (via Jmol)


maho@riken.jp/maho.nakata@gmail.com